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BibTeX records: Peter V. Coveney
@article{DBLP:journals/cphysics/ZacharoudiouMC23, author = {I. Zacharoudiou and J. W. S. McCullough and Peter V. Coveney}, title = {Development and performance of a HemeLB {GPU} code for human-scale blood flow simulation}, journal = {Comput. Phys. Commun.}, volume = {282}, pages = {108548}, year = {2023}, url = {https://doi.org/10.1016/j.cpc.2022.108548}, doi = {10.1016/J.CPC.2022.108548}, timestamp = {Sat, 13 May 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/cphysics/ZacharoudiouMC23.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/cphysics/GroenASERXBMC23, author = {Derek Groen and Hamid Arabnejad and Diana Suleimenova and Wouter Edeling and Erwan Raffin and Yani Xue and Kevin Bronik and Nicolas Monnier and Peter V. Coveney}, title = {FabSim3: An automation toolkit for verified simulations using high performance computing}, journal = {Comput. Phys. Commun.}, volume = {283}, pages = {108596}, year = {2023}, url = {https://doi.org/10.1016/j.cpc.2022.108596}, doi = {10.1016/J.CPC.2022.108596}, timestamp = {Tue, 21 Mar 2023 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/cphysics/GroenASERXBMC23.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcisd/BieniekWBWC23, author = {Mateusz K. Bieniek and Alexander D. Wade and Agastya P. Bhati and Shunzhou Wan and Peter V. Coveney}, title = {{TIES} 2.0: {A} Dual-Topology Open Source Relative Binding Free Energy Builder with Web Portal}, journal = {J. Chem. Inf. Model.}, volume = {63}, number = {3}, pages = {718--724}, year = {2023}, url = {https://doi.org/10.1021/acs.jcim.2c01596}, doi = {10.1021/ACS.JCIM.2C01596}, timestamp = {Sat, 30 Sep 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jcisd/BieniekWBWC23.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcisd/WanBWC23, author = {Shunzhou Wan and Agastya P. Bhati and Alexander D. Wade and Peter V. Coveney}, title = {Ensemble-Based Approaches Ensure Reliability and Reproducibility}, journal = {J. Chem. Inf. Model.}, volume = {63}, number = {22}, pages = {6959--6963}, year = {2023}, url = {https://doi.org/10.1021/acs.jcim.3c01654}, doi = {10.1021/ACS.JCIM.3C01654}, timestamp = {Sun, 31 Dec 2023 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jcisd/WanBWC23.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcisd/WanBWWGGC22, author = {Shunzhou Wan and Agastya P. Bhati and David W. Wright and Ian D. Wall and Alan P. Graves and Darren V. S. Green and Peter V. Coveney}, title = {Ensemble Simulations and Experimental Free Energy Distributions: Evaluation and Characterization of Isoxazole Amides as {SMYD3} Inhibitors}, journal = {J. Chem. Inf. Model.}, volume = {62}, number = {10}, pages = {2561--2570}, year = {2022}, url = {https://doi.org/10.1021/acs.jcim.2c00255}, doi = {10.1021/ACS.JCIM.2C00255}, timestamp = {Sat, 30 Sep 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jcisd/WanBWWGGC22.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/tjs/MorilloVCG22, author = {Julian Morillo and Maxime Vassaux and Peter V. Coveney and Marta Garcia{-}Gasulla}, title = {Hybrid parallelization of molecular dynamics simulations to reduce load imbalance}, journal = {J. Supercomput.}, volume = {78}, number = {7}, pages = {9184--9215}, year = {2022}, url = {https://doi.org/10.1007/s11227-021-04214-4}, doi = {10.1007/S11227-021-04214-4}, timestamp = {Tue, 21 Mar 2023 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/tjs/MorilloVCG22.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/iccS/BronikRVEC22, author = {Kevin Bronik and Werner Muller Roa and Maxime Vassaux and Wouter Edeling and Peter V. Coveney}, editor = {Derek Groen and Cl{\'{e}}lia de Mulatier and Maciej Paszynski and Valeria V. Krzhizhanovskaya and Jack J. Dongarra and Peter M. A. Sloot}, title = {Automated Variance-Based Sensitivity Analysis of a Heterogeneous Atomistic-Continuum System}, booktitle = {Computational Science - {ICCS} 2022 - 22nd International Conference, London, UK, June 21-23, 2022, Proceedings, Part {IV}}, series = {Lecture Notes in Computer Science}, volume = {13353}, pages = {762--766}, publisher = {Springer}, year = {2022}, url = {https://doi.org/10.1007/978-3-031-08760-8\_62}, doi = {10.1007/978-3-031-08760-8\_62}, timestamp = {Tue, 21 Mar 2023 00:00:00 +0100}, biburl = {https://dblp.org/rec/conf/iccS/BronikRVEC22.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/abs-2202-11770, author = {I. Zacharoudiou and J. W. S. McCullough and Peter V. Coveney}, title = {Development and performance of a HemeLB {GPU} code for human-scale blood flow simulation}, journal = {CoRR}, volume = {abs/2202.11770}, year = {2022}, url = {https://arxiv.org/abs/2202.11770}, eprinttype = {arXiv}, eprint = {2202.11770}, timestamp = {Mon, 05 Sep 2022 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/corr/abs-2202-11770.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jocs/SuleimenovaAECL21, author = {Diana Suleimenova and Hamid Arabnejad and Wouter Edeling and David Coster and Onnie O. Luk and Jalal Lakhlili and Vytautas Jancauskas and Michal Kulczewski and Lourens E. Veen and Dongwei Ye and Pavel Zun and Valeria V. Krzhizhanovskaya and Alfons G. Hoekstra and Daan Crommelin and Peter V. Coveney and Derek Groen}, title = {Tutorial applications for Verification, Validation and Uncertainty Quantification using {VECMA} toolkit}, journal = {J. Comput. Sci.}, volume = {53}, pages = {101402}, year = {2021}, url = {https://doi.org/10.1016/j.jocs.2021.101402}, doi = {10.1016/J.JOCS.2021.101402}, timestamp = {Sun, 02 Oct 2022 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jocs/SuleimenovaAECL21.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/icpp/SaadiABBBBBCCCC21, author = {Aymen Al Saadi and Dario Alf{\`{e}} and Yadu N. Babuji and Agastya Bhati and Ben Blaiszik and Alexander Brace and Thomas S. Brettin and Kyle Chard and Ryan Chard and Austin Clyde and Peter V. Coveney and Ian T. Foster and Tom Gibbs and Shantenu Jha and Kristopher Keipert and Dieter Kranzlm{\"{u}}ller and Thorsten Kurth and Hyungro Lee and Zhuozhao Li and Heng Ma and Gerald Mathias and Andr{\'{e}} Merzky and Alexander Partin and Arvind Ramanathan and Ashka Shah and Abraham C. Stern and Rick Stevens and Li Tan and Mikhail Titov and Anda Trifan and Aristeidis Tsaris and Matteo Turilli and Huub J. J. Van Dam and Shunzhou Wan and David Wifling and Junqi Yin}, editor = {Xian{-}He Sun and Sameer Shende and Laxmikant V. Kal{\'{e}} and Yong Chen}, title = {{IMPECCABLE:} Integrated Modeling PipelinE for {COVID} Cure by Assessing Better LEads}, booktitle = {{ICPP} 2021: 50th International Conference on Parallel Processing, Lemont, IL, USA, August 9 - 12, 2021}, pages = {40:1--40:12}, publisher = {{ACM}}, year = {2021}, url = {https://doi.org/10.1145/3472456.3473524}, doi = {10.1145/3472456.3473524}, timestamp = {Mon, 05 Feb 2024 00:00:00 +0100}, biburl = {https://dblp.org/rec/conf/icpp/SaadiABBBBBCCCC21.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/pasc/LeeMTTTABBCCMRS21, author = {Hyungro Lee and Andr{\'{e}} Merzky and Li Tan and Mikhail Titov and Matteo Turilli and Dario Alf{\`{e}} and Agastya Bhati and Alex Brace and Austin Clyde and Peter V. Coveney and Heng Ma and Arvind Ramanathan and Rick Stevens and Anda Trifan and Hubertus Van Dam and Shunzhou Wan and Sean R. Wilkinson and Shantenu Jha}, editor = {Timothy Robinson}, title = {Scalable {HPC} {\&} {AI} infrastructure for {COVID-19} therapeutics}, booktitle = {{PASC} '21: Platform for Advanced Scientific Computing Conference, Geneva, Switzerland, July 5-9, 2021}, pages = {2:1--2:13}, publisher = {{ACM}}, year = {2021}, url = {https://doi.org/10.1145/3468267.3470573}, doi = {10.1145/3468267.3470573}, timestamp = {Mon, 05 Feb 2024 00:00:00 +0100}, biburl = {https://dblp.org/rec/conf/pasc/LeeMTTTABBCCMRS21.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/abs-2103-02843, author = {Agastya P. Bhati and Shunzhou Wan and Dario Alf{\`{e}} and Austin R. Clyde and Mathis Bode and Li Tan and Mikhail Titov and Andr{\'{e}} Merzky and Matteo Turilli and Shantenu Jha and Roger R. Highfield and Walter Rocchia and Nicola Scafuri and Sauro Succi and Dieter Kranzlm{\"{u}}ller and Gerald Mathias and David Wifling and Yann Donon and Alberto Di Meglio and Sofia Vallecorsa and Heng Ma and Anda Trifan and Arvind Ramanathan and Tom Brettin and Alexander Partin and Fangfang Xia and Xiaotan Duan and Rick Stevens and Peter V. Coveney}, title = {Pandemic Drugs at Pandemic Speed: Accelerating {COVID-19} Drug Discovery with Hybrid Machine Learning- and Physics-based Simulations on High Performance Computers}, journal = {CoRR}, volume = {abs/2103.02843}, year = {2021}, url = {https://arxiv.org/abs/2103.02843}, eprinttype = {arXiv}, eprint = {2103.02843}, timestamp = {Mon, 15 Mar 2021 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/corr/abs-2103-02843.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/cars/EsfahaniZCABADY20, author = {Sahar Soheilian Esfahani and Xiaojun Zhai and Minsi Chen and Abbes Amira and Faycal Bensaali and Julien Abinahed and Sarada Dakua and Georges Younes and Abdulla Baobeid and Robin A. Richardson and Peter V. Coveney}, title = {Lattice-Boltzmann interactive blood flow simulation pipeline}, journal = {Int. J. Comput. Assist. Radiol. Surg.}, volume = {15}, number = {4}, pages = {629--639}, year = {2020}, url = {https://doi.org/10.1007/s11548-020-02120-3}, doi = {10.1007/S11548-020-02120-3}, timestamp = {Sat, 09 Apr 2022 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/cars/EsfahaniZCABADY20.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jocs/CoveneyH20, author = {Peter V. Coveney and Roger R. Highfield}, title = {From digital hype to analogue reality: Universal simulation beyond the quantum and exascale eras}, journal = {J. Comput. Sci.}, volume = {46}, pages = {101093}, year = {2020}, url = {https://doi.org/10.1016/j.jocs.2020.101093}, doi = {10.1016/J.JOCS.2020.101093}, timestamp = {Tue, 01 Jun 2021 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jocs/CoveneyH20.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/sj/ZhaiCEABADRC20, author = {Xiaojun Zhai and Minsi Chen and Sahar Soheilian Esfahani and Abbes Amira and Faycal Bensaali and Julien Abinahed and Sarada Dakua and Robin A. Richardson and Peter V. Coveney}, title = {Heterogeneous System-on-Chip-Based Lattice-Boltzmann Visual Simulation System}, journal = {{IEEE} Syst. J.}, volume = {14}, number = {2}, pages = {1592--1601}, year = {2020}, url = {https://doi.org/10.1109/JSYST.2019.2952459}, doi = {10.1109/JSYST.2019.2952459}, timestamp = {Thu, 27 Jul 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/sj/ZhaiCEABADRC20.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/abs-2007-03741, author = {Peter V. Coveney and Roger R. Highfield}, title = {When we can trust computers (and when we can't)}, journal = {CoRR}, volume = {abs/2007.03741}, year = {2020}, url = {https://arxiv.org/abs/2007.03741}, eprinttype = {arXiv}, eprint = {2007.03741}, timestamp = {Sat, 23 Jan 2021 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/corr/abs-2007-03741.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/abs-2010-03923, author = {Derek Groen and Hamid Arabnejad and Vytautas Jancauskas and Wouter Edeling and Fredrik Jansson and Robin A. Richardson and Jalal Lakhlili and Linda van Veen and Bartosz Bosak and Piotr Kopta and D. W. Wright and Nicolas Monnier and Paul Karlshoefer and Diana Suleimenova and Robert Sinclair and Maxime Vassaux and Anna Nikishova and Mariusz Bieniek and Onnie O. Luk and Michal Kulczewski and Erwan Raffin and Daan Crommelin and Olivier Hoenen and David P. Coster and Tomasz Piontek and Peter V. Coveney}, title = {VECMAtk: {A} Scalable Verification, Validation and Uncertainty Quantification Toolkit for Scientific Simulations}, journal = {CoRR}, volume = {abs/2010.03923}, year = {2020}, url = {https://arxiv.org/abs/2010.03923}, eprinttype = {arXiv}, eprint = {2010.03923}, timestamp = {Mon, 07 Nov 2022 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/corr/abs-2010-03923.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/abs-2010-06574, author = {Aymen Al Saadi and Dario Alf{\`{e}} and Yadu N. Babuji and Agastya Bhati and Ben Blaiszik and Thomas S. Brettin and Kyle Chard and Ryan Chard and Peter V. Coveney and Anda Trifan and Alex Brace and Austin Clyde and Ian T. Foster and Tom Gibbs and Shantenu Jha and Kristopher Keipert and Thorsten Kurth and Dieter Kranzlm{\"{u}}ller and Hyungro Lee and Zhuozhao Li and Heng Ma and Andr{\'{e}} Merzky and Gerald Mathias and Alexander Partin and Junqi Yin and Arvind Ramanathan and Ashka Shah and Abraham C. Stern and Rick Stevens and Li Tan and Mikhail Titov and Aristeidis Tsaris and Matteo Turilli and Huub J. J. Van Dam and Shunzhou Wan and David Wifling}, title = {{IMPECCABLE:} Integrated Modeling PipelinE for {COVID} Cure by Assessing Better LEads}, journal = {CoRR}, volume = {abs/2010.06574}, year = {2020}, url = {https://arxiv.org/abs/2010.06574}, eprinttype = {arXiv}, eprint = {2010.06574}, timestamp = {Thu, 14 Oct 2021 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/corr/abs-2010-06574.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/abs-2010-10517, author = {Hyungro Lee and Andr{\'{e}} Merzky and Li Tan and Mikhail Titov and Matteo Turilli and Dario Alf{\`{e}} and Agastya Bhati and Alex Brace and Austin Clyde and Peter V. Coveney and Heng Ma and Arvind Ramanathan and Rick Stevens and Anda Trifan and Hubertus Van Dam and Shunzhou Wan and Sean R. Wilkinson and Shantenu Jha}, title = {Scalable {HPC} and {AI} Infrastructure for {COVID-19} Therapeutics}, journal = {CoRR}, volume = {abs/2010.10517}, year = {2020}, url = {https://arxiv.org/abs/2010.10517}, eprinttype = {arXiv}, eprint = {2010.10517}, timestamp = {Thu, 22 Dec 2022 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/corr/abs-2010-10517.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/entropy/TranterLMWC19, author = {Andrew Tranter and Peter J. Love and Florian Mintert and Nathan Wiebe and Peter V. Coveney}, title = {Ordering of Trotterization: Impact on Errors in Quantum Simulation of Electronic Structure}, journal = {Entropy}, volume = {21}, number = {12}, pages = {1218}, year = {2019}, url = {https://doi.org/10.3390/e21121218}, doi = {10.3390/E21121218}, timestamp = {Mon, 13 Jan 2020 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/entropy/TranterLMWC19.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/fgcs/AlowayyedPSHGLB19, author = {Saad Alowayyed and Tomasz Piontek and James L. Suter and Olivier Hoenen and Derek Groen and Onnie Luk and Bartosz Bosak and Piotr Kopta and Krzysztof Kurowski and Oliver Perks and Keeran Brabazon and Vytautas Jancauskas and David Coster and Peter V. Coveney and Alfons G. Hoekstra}, title = {Patterns for High Performance Multiscale Computing}, journal = {Future Gener. Comput. Syst.}, volume = {91}, pages = {335--346}, year = {2019}, url = {https://doi.org/10.1016/j.future.2018.08.045}, doi = {10.1016/J.FUTURE.2018.08.045}, timestamp = {Mon, 26 Jun 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/fgcs/AlowayyedPSHGLB19.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcisd/SinclairC19, author = {Robert Sinclair and Peter V. Coveney}, title = {Modeling Nanostructure in Graphene Oxide: Inhomogeneity and the Percolation Threshold}, journal = {J. Chem. Inf. Model.}, volume = {59}, number = {6}, pages = {2741--2745}, year = {2019}, url = {https://doi.org/10.1021/acs.jcim.9b00114}, doi = {10.1021/ACS.JCIM.9B00114}, timestamp = {Tue, 01 Jun 2021 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jcisd/SinclairC19.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/superfri/AlowayyedVCCH19, author = {Saad Alowayyed and Maxime Vassaux and Benjamin Czaja and Peter V. Coveney and Alfons G. Hoekstra}, title = {Towards Heterogeneous Multi-scale Computing on Large Scale Parallel Supercomputers}, journal = {Supercomput. Front. Innov.}, volume = {6}, number = {4}, pages = {20--43}, year = {2019}, url = {https://doi.org/10.14529/jsfi190402}, doi = {10.14529/JSFI190402}, timestamp = {Sun, 02 Oct 2022 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/superfri/AlowayyedVCCH19.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/iccS/GroenRWJSKVAPKB19, author = {Derek Groen and Robin A. Richardson and David W. Wright and Vytautas Jancauskas and Robert Sinclair and Paul Karlshoefer and Maxime Vassaux and Hamid Arabnejad and Tomasz Piontek and Piotr Kopta and Bartosz Bosak and Jalal Lakhlili and Olivier Hoenen and Diana Suleimenova and Wouter Edeling and Daan Crommelin and Anna Nikishova and Peter V. Coveney}, editor = {Jo{\~{a}}o M. F. Rodrigues and Pedro J. S. Cardoso and J{\^{a}}nio M. Monteiro and Roberto Lam and Valeria V. Krzhizhanovskaya and Michael Harold Lees and Jack J. Dongarra and Peter M. A. Sloot}, title = {Introducing VECMAtk - Verification, Validation and Uncertainty Quantification for Multiscale and {HPC} Simulations}, booktitle = {Computational Science - {ICCS} 2019 - 19th International Conference, Faro, Portugal, June 12-14, 2019, Proceedings, Part {IV}}, series = {Lecture Notes in Computer Science}, volume = {11539}, pages = {479--492}, publisher = {Springer}, year = {2019}, url = {https://doi.org/10.1007/978-3-030-22747-0\_36}, doi = {10.1007/978-3-030-22747-0\_36}, timestamp = {Mon, 26 Jun 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/conf/iccS/GroenRWJSKVAPKB19.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/icip/EsfahaniCZCABAD19, author = {Sahar Soheilian Esfahani and Peter V. Coveney and Xiaojun Zhai and Minsi Chen and Abbes Amira and Faycal Bensaali and Julien Abinahed and Sarada Dakua and Georges Younes and Robin A. Richardson}, title = {Hemelb Acceleration and Visualization for Cerebral Aneurysms}, booktitle = {2019 {IEEE} International Conference on Image Processing, {ICIP} 2019, Taipei, Taiwan, September 22-25, 2019}, pages = {1376--1380}, publisher = {{IEEE}}, year = {2019}, url = {https://doi.org/10.1109/ICIP.2019.8803712}, doi = {10.1109/ICIP.2019.8803712}, timestamp = {Sat, 09 Apr 2022 01:00:00 +0200}, biburl = {https://dblp.org/rec/conf/icip/EsfahaniCZCABAD19.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/abs-1906-11925, author = {Sahar Soheilian Esfahani and Xiaojun Zhai and Minsi Chen and Abbes Amira and Faycal Bensaali and Julien Abinahed and Sarada Dakua and Georges Younes and Robin A. Richardson and Peter V. Coveney}, title = {{HEMELB} Acceleration and Visualization for Cerebral Aneurysms}, journal = {CoRR}, volume = {abs/1906.11925}, year = {2019}, url = {http://arxiv.org/abs/1906.11925}, eprinttype = {arXiv}, eprint = {1906.11925}, timestamp = {Mon, 29 Mar 2021 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/corr/abs-1906-11925.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/bmcbi/DakkaTWZBWCJ18, author = {Jumana Dakka and Matteo Turilli and David W. Wright and Stefan J. Zasada and Vivek Balasubramanian and Shunzhou Wan and Peter V. Coveney and Shantenu Jha}, title = {High-throughput binding affinity calculations at extreme scales}, journal = {{BMC} Bioinform.}, volume = {19-S}, number = {18}, pages = {33--45}, year = {2018}, url = {https://doi.org/10.1186/s12859-018-2506-6}, doi = {10.1186/S12859-018-2506-6}, timestamp = {Tue, 21 Mar 2023 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/bmcbi/DakkaTWZBWCJ18.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/ccgrid/DakkaFBTWWZCJ18, author = {Jumana Dakka and Kristof Farkas{-}Pall and Vivek Balasubramanian and Matteo Turilli and Shunzhou Wan and David W. Wright and Stefan J. Zasada and Peter V. Coveney and Shantenu Jha}, editor = {Esam El{-}Araby and Dhabaleswar K. Panda and Sandra Gesing and Amy W. Apon and Volodymyr V. Kindratenko and Massimo Cafaro and Alfredo Cuzzocrea}, title = {Enabling Trade-offs Between Accuracy and Computational Cost: Adaptive Algorithms to Reduce Time to Clinical Insight}, booktitle = {18th {IEEE/ACM} International Symposium on Cluster, Cloud and Grid Computing, {CCGRID} 2018, Washington, DC, USA, May 1-4, 2018}, pages = {572--577}, publisher = {{IEEE} Computer Society}, year = {2018}, url = {https://doi.org/10.1109/CCGRID.2018.00005}, doi = {10.1109/CCGRID.2018.00005}, timestamp = {Sat, 30 Sep 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/conf/ccgrid/DakkaFBTWWZCJ18.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/eScience/DakkaFTWCJ18, author = {Jumana Dakka and Kristof Farkas{-}Pall and Matteo Turilli and David W. Wright and Peter V. Coveney and Shantenu Jha}, title = {Concurrent and Adaptive Extreme Scale Binding Free Energy Calculations}, booktitle = {14th {IEEE} International Conference on e-Science, e-Science 2018, Amsterdam, The Netherlands, October 29 - November 1, 2018}, pages = {189--200}, publisher = {{IEEE} Computer Society}, year = {2018}, url = {https://doi.org/10.1109/eScience.2018.00034}, doi = {10.1109/ESCIENCE.2018.00034}, timestamp = {Sat, 30 Sep 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/conf/eScience/DakkaFTWCJ18.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/abs-1801-01174, author = {Jumana Dakka and Kristof Farkas{-}Pall and Vivek Balasubramanian and Matteo Turilli and David W. Wright and Shunzhou Wan and Stefan J. Zasada and Peter V. Coveney and Shantenu Jha}, title = {Rapid, concurrent and adaptive extreme scale binding free energy calculation}, journal = {CoRR}, volume = {abs/1801.01174}, year = {2018}, url = {http://arxiv.org/abs/1801.01174}, eprinttype = {arXiv}, eprint = {1801.01174}, timestamp = {Mon, 07 Sep 2020 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/corr/abs-1801-01174.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/abs-1807-09515, author = {Sauro Succi and Peter V. Coveney}, title = {Big Data: the End of the Scientific Method?}, journal = {CoRR}, volume = {abs/1807.09515}, year = {2018}, url = {http://arxiv.org/abs/1807.09515}, eprinttype = {arXiv}, eprint = {1807.09515}, timestamp = {Mon, 13 Aug 2018 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/corr/abs-1807-09515.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/peerjpre/WrightRC18, author = {David W. Wright and Robin A. Richardson and Peter V. Coveney}, title = {Practical challenges for biomedical modeling using {HPC}}, journal = {PeerJ Prepr.}, volume = {6}, pages = {e27299}, year = {2018}, url = {https://doi.org/10.7287/peerj.preprints.27299v1}, doi = {10.7287/PEERJ.PREPRINTS.27299V1}, timestamp = {Mon, 07 Sep 2020 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/peerjpre/WrightRC18.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/aes/PuurtinenTMHNCT17, author = {Tuomas Puurtinen and Jukka I. Toivanen and Keijo Mattila and Jari Hyv{\"{a}}luoma and Rupert W. Nash and Peter V. Coveney and Jussi Timonen}, title = {Coupling of lattice-Boltzmann solvers with suspended particles using the {MPI} intercommunication framework}, journal = {Adv. Eng. Softw.}, volume = {111}, pages = {52--57}, year = {2017}, url = {https://doi.org/10.1016/j.advengsoft.2016.07.008}, doi = {10.1016/J.ADVENGSOFT.2016.07.008}, timestamp = {Wed, 16 Mar 2022 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/aes/PuurtinenTMHNCT17.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/cphysics/SchmieschekSFKS17, author = {Sebastian Schmieschek and Lev Shamardin and Stefan Frijters and Timm Kr{\"{u}}ger and Ulf D. Schiller and Jens Harting and Peter V. Coveney}, title = {{LB3D:} {A} parallel implementation of the Lattice-Boltzmann method for simulation of interacting amphiphilic fluids}, journal = {Comput. Phys. Commun.}, volume = {217}, pages = {149--161}, year = {2017}, url = {https://doi.org/10.1016/j.cpc.2017.03.013}, doi = {10.1016/J.CPC.2017.03.013}, timestamp = {Fri, 21 Feb 2020 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/cphysics/SchmieschekSFKS17.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcisd/WanBSOSBC17, author = {Shunzhou Wan and Agastya Bhati and Sarah Skerratt and Kiyoyuki Omoto and Veerabahu Shanmugasundaram and Sharan K. Bagal and Peter V. Coveney}, title = {Evaluation and Characterization of Trk Kinase Inhibitors for the Treatment of Pain: Reliable Binding Affinity Predictions from Theory and Computation}, journal = {J. Chem. Inf. Model.}, volume = {57}, number = {4}, pages = {897--909}, year = {2017}, url = {https://doi.org/10.1021/acs.jcim.6b00780}, doi = {10.1021/ACS.JCIM.6B00780}, timestamp = {Thu, 14 Oct 2021 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jcisd/WanBSOSBC17.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jocs/AlowayyedGCH17, author = {Saad Alowayyed and Derek Groen and Peter V. Coveney and Alfons G. Hoekstra}, title = {Multiscale computing in the exascale era}, journal = {J. Comput. Sci.}, volume = {22}, pages = {15--25}, year = {2017}, url = {https://doi.org/10.1016/j.jocs.2017.07.004}, doi = {10.1016/J.JOCS.2017.07.004}, timestamp = {Tue, 25 Feb 2020 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jocs/AlowayyedGCH17.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/abs-1712-09168, author = {Jumana Dakka and Matteo Turilli and David W. Wright and Stefan J. Zasada and Vivek Balasubramanian and Shunzhou Wan and Peter V. Coveney and Shantenu Jha}, title = {High-throughput Binding Affinity Calculations at Extreme Scales}, journal = {CoRR}, volume = {abs/1712.09168}, year = {2017}, url = {http://arxiv.org/abs/1712.09168}, eprinttype = {arXiv}, eprint = {1712.09168}, timestamp = {Mon, 07 Sep 2020 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/corr/abs-1712-09168.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/cphysics/GroenBSHZC16, author = {Derek Groen and Agastya Bhati and James J. Suter and James Hetherington and Stefan J. Zasada and Peter V. Coveney}, title = {FabSim: Facilitating computational research through automation on large-scale and distributed e-infrastructures}, journal = {Comput. Phys. Commun.}, volume = {207}, pages = {375--385}, year = {2016}, url = {https://doi.org/10.1016/j.cpc.2016.05.020}, doi = {10.1016/J.CPC.2016.05.020}, timestamp = {Thu, 14 Oct 2021 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/cphysics/GroenBSHZC16.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/AlowayyedGCH16, author = {Saad Alowayyed and Derek Groen and Peter V. Coveney and Alfons G. Hoekstra}, title = {Multiscale Computing in the Exascale Era}, journal = {CoRR}, volume = {abs/1612.02467}, year = {2016}, url = {http://arxiv.org/abs/1612.02467}, eprinttype = {arXiv}, eprint = {1612.02467}, timestamp = {Mon, 13 Aug 2018 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/corr/AlowayyedGCH16.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jocs/ItaniSSHBCRCG15, author = {Mohamed A. Itani and Ulf D. Schiller and Sebastian Schmieschek and James Hetherington and Miguel O. Bernabeu and Hoskote Chandrashekar and Fergus Robertson and Peter V. Coveney and Derek Groen}, title = {An automated multiscale ensemble simulation approach for vascular blood flow}, journal = {J. Comput. Sci.}, volume = {9}, pages = {150--155}, year = {2015}, url = {https://doi.org/10.1016/j.jocs.2015.04.008}, doi = {10.1016/J.JOCS.2015.04.008}, timestamp = {Tue, 25 Feb 2020 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jocs/ItaniSSHBCRCG15.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/embc/BernabeuLLACS15, author = {Miguel O. Bernabeu and Yang Lu and Jan Lammer and Lloyd Paul Aiello and Peter V. Coveney and Jennifer K. Sun}, title = {Characterization of parafoveal hemodynamics associated with diabetic retinopathy with adaptive optics scanning laser ophthalmoscopy and computational fluid dynamics}, booktitle = {37th Annual International Conference of the {IEEE} Engineering in Medicine and Biology Society, {EMBC} 2015, Milan, Italy, August 25-29, 2015}, pages = {8070--8073}, publisher = {{IEEE}}, year = {2015}, url = {https://doi.org/10.1109/EMBC.2015.7320266}, doi = {10.1109/EMBC.2015.7320266}, timestamp = {Sun, 25 Oct 2020 01:00:00 +0200}, biburl = {https://dblp.org/rec/conf/embc/BernabeuLLACS15.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/xsede/SamuelWCRMGW15, author = {Tabitha K. Samuel and Shunzhou Wan and Peter V. Coveney and Morris Riedel and M. Shahbaz Memon and Sandra Gesing and Nancy Wilkins{-}Diehr}, editor = {Gregory D. Peterson}, title = {Overview of {XSEDE-PRACE} collaborative projects in 2014}, booktitle = {Proceedings of the 2015 {XSEDE} Conference: Scientific Advancements Enabled by Enhanced Cyberinfrastructure, St. Louis, MO, USA, July 26 - 30, 2015}, pages = {24:1--24:8}, publisher = {{ACM}}, year = {2015}, url = {https://doi.org/10.1145/2792745.2792769}, doi = {10.1145/2792745.2792769}, timestamp = {Tue, 06 Nov 2018 00:00:00 +0100}, biburl = {https://dblp.org/rec/conf/xsede/SamuelWCRMGW15.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/ItaniSSHBCRCG15, author = {Mohamed A. Itani and Ulf D. Schiller and Sebastian Schmieschek and James Hetherington and Miguel O. Bernabeu and Hoskote Chandrashekar and Fergus Robertson and Peter V. Coveney and Derek Groen}, title = {An automated multiscale ensemble simulation approach for vascular blood flow}, journal = {CoRR}, volume = {abs/1504.07795}, year = {2015}, url = {http://arxiv.org/abs/1504.07795}, eprinttype = {arXiv}, eprint = {1504.07795}, timestamp = {Mon, 13 Aug 2018 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/corr/ItaniSSHBCRCG15.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/GroenBSHZC15, author = {Derek Groen and Agastya Bhati and James J. Suter and James Hetherington and Stefan J. Zasada and Peter V. Coveney}, title = {FabSim: facilitating computational research through automation on large-scale and distributed e-infrastructures}, journal = {CoRR}, volume = {abs/1512.02194}, year = {2015}, url = {http://arxiv.org/abs/1512.02194}, eprinttype = {arXiv}, eprint = {1512.02194}, timestamp = {Mon, 13 Aug 2018 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/corr/GroenBSHZC15.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/ZasadaC15, author = {Stefan J. Zasada and Peter V. Coveney}, title = {A Distributed Multi-agent Market Place for {HPC} Compute Cycle Resource Trading}, journal = {CoRR}, volume = {abs/1512.04343}, year = {2015}, url = {http://arxiv.org/abs/1512.04343}, eprinttype = {arXiv}, eprint = {1512.04343}, timestamp = {Mon, 13 Aug 2018 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/corr/ZasadaC15.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/cse/GroenZC14, author = {Derek Groen and Stefan J. Zasada and Peter V. Coveney}, title = {Survey of Multiscale and Multiphysics Applications and Communities}, journal = {Comput. Sci. Eng.}, volume = {16}, number = {2}, pages = {34--43}, year = {2014}, url = {https://doi.org/10.1109/MCSE.2013.47}, doi = {10.1109/MCSE.2013.47}, timestamp = {Thu, 12 Mar 2020 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/cse/GroenZC14.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcc/MartinJC14, author = {Hugh S. C. Martin and Shantenu Jha and Peter V. Coveney}, title = {Comparative analysis of nucleotide translocation through protein nanopores using steered molecular dynamics and an adaptive biasing force}, journal = {J. Comput. Chem.}, volume = {35}, number = {9}, pages = {692--702}, year = {2014}, url = {https://doi.org/10.1002/jcc.23525}, doi = {10.1002/JCC.23525}, timestamp = {Tue, 21 Mar 2023 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jcc/MartinJC14.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jocs/ZasadaCHC14, author = {Stefan J. Zasada and David Chan{-}Wei Chang and Ali Nasrat Haidar and Peter V. Coveney}, title = {Flexible composition and execution of large scale applications on distributed e-infrastructures}, journal = {J. Comput. Sci.}, volume = {5}, number = {1}, pages = {51--62}, year = {2014}, url = {https://doi.org/10.1016/j.jocs.2013.10.009}, doi = {10.1016/J.JOCS.2013.10.009}, timestamp = {Tue, 25 Feb 2020 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jocs/ZasadaCHC14.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jocs/BorgdorffMBKBCGCH14, author = {Joris Borgdorff and Mariusz Mamonski and Bartosz Bosak and Krzysztof Kurowski and Mohamed Ben Belgacem and Bastien Chopard and Derek Groen and Peter V. Coveney and Alfons G. Hoekstra}, title = {Distributed multiscale computing with {MUSCLE} 2, the Multiscale Coupling Library and Environment}, journal = {J. Comput. Sci.}, volume = {5}, number = {5}, pages = {719--731}, year = {2014}, url = {https://doi.org/10.1016/j.jocs.2014.04.004}, doi = {10.1016/J.JOCS.2014.04.004}, timestamp = {Fri, 09 Apr 2021 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jocs/BorgdorffMBKBCGCH14.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/amia/MaresSWASNZGC14, author = {J. Mar{\'{e}}s and Lev Shamardin and Gabriele Weiler and Alberto Anguita and Stelios Sfakianakis and Elias Neri and Stefan J. Zasada and Norbert M. Graf and Peter V. Coveney}, title = {p-medicine: {A} Medical Informatics Platform for Integrated Large Scale Heterogeneous Patient Data}, booktitle = {{AMIA} 2014, American Medical Informatics Association Annual Symposium, Washington, DC, USA, November 15-19, 2014}, publisher = {{AMIA}}, year = {2014}, url = {https://knowledge.amia.org/56638-amia-1.1540970/t-004-1.1544972/f-004-1.1544973/a-185-1.1545118/a-186-1.1545115}, timestamp = {Wed, 04 Aug 2021 11:13:07 +0200}, biburl = {https://dblp.org/rec/conf/amia/MaresSWASNZGC14.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/easc/GroenCNJBC14, author = {Derek Groen and David Abou Chacra and Rupert W. Nash and Jir{\'{\i}} Jaros and Miguel O. Bernabeu and Peter V. Coveney}, editor = {Stefano Markidis and Erwin Laure}, title = {Weighted Decomposition in High-Performance Lattice-Boltzmann Simulations: Are Some Lattice Sites More Equal than Others?}, booktitle = {Solving Software Challenges for Exascale - International Conference on Exascale Applications and Software, {EASC} 2014, Stockholm, Sweden, April 2-3, 2014, Revised Selected Papers}, series = {Lecture Notes in Computer Science}, volume = {8759}, pages = {28--38}, publisher = {Springer}, year = {2014}, url = {https://doi.org/10.1007/978-3-319-15976-8\_2}, doi = {10.1007/978-3-319-15976-8\_2}, timestamp = {Tue, 14 May 2019 10:00:43 +0200}, biburl = {https://dblp.org/rec/conf/easc/GroenCNJBC14.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/GroenCNJBC14, author = {Derek Groen and David Abou Chacra and Rupert W. Nash and Jir{\'{\i}} Jaros and Miguel O. Bernabeu and Peter V. Coveney}, title = {Weighted decomposition in high-performance lattice-Boltzmann simulations: are some lattice sites more equal than others?}, journal = {CoRR}, volume = {abs/1410.4713}, year = {2014}, url = {http://arxiv.org/abs/1410.4713}, eprinttype = {arXiv}, eprint = {1410.4713}, timestamp = {Mon, 13 Aug 2018 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/corr/GroenCNJBC14.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/ijdc/LecarpentierWEMKCB13, author = {Damien Lecarpentier and Peter Wittenburg and Willem Elbers and Alberto Michelini and Riam Kanso and Peter V. Coveney and Rob Baxter}, title = {{EUDAT:} {A} New Cross-Disciplinary Data Infrastructure for Science}, journal = {Int. J. Digit. Curation}, volume = {8}, number = {1}, pages = {279--287}, year = {2013}, url = {https://doi.org/10.2218/ijdc.v8i1.260}, doi = {10.2218/IJDC.V8I1.260}, timestamp = {Wed, 22 Jul 2020 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/ijdc/LecarpentierWEMKCB13.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jisa/RiedelWRSRVFMMCEBVELBTCZHBMMMHSLKL13, author = {Morris Riedel and Peter Wittenburg and Johannes Reetz and Mark van de Sanden and Jedrzej Rybicki and Benedikt von St. Vieth and Giuseppe Fiameni and Giacomo Mariani and Alberto Michelini and Claudio Cacciari and Willem Elbers and Daan Broeder and Robert Verkerk and Elena Erastova and Michael Lautenschlaeger and Reinhard Budig and Hannes Thiemann and Peter V. Coveney and Stefan J. Zasada and Ali Nasrat Haidar and Otto Buechner and Cristina Manzano and A. Shiraz Memon and Ahmed Shiraz Memon and Heikki Helin and Jari Suhonen and Damien Lecarpentier and Kimmo Koski and Thomas Lippert}, title = {A data infrastructure reference model with applications: towards realization of a ScienceTube vision with a data replication service}, journal = {J. Internet Serv. Appl.}, volume = {4}, number = {1}, pages = {1:1--1:17}, year = {2013}, url = {https://doi.org/10.1186/1869-0238-4-1}, doi = {10.1186/1869-0238-4-1}, timestamp = {Sat, 30 Sep 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jisa/RiedelWRSRVFMMCEBVELBTCZHBMMMHSLKL13.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jocs/GroenHCNBC13, author = {Derek Groen and James Hetherington and Hywel B. Carver and Rupert W. Nash and Miguel O. Bernabeu and Peter V. Coveney}, title = {Analysing and modelling the performance of the HemeLB lattice-Boltzmann simulation environment}, journal = {J. Comput. Sci.}, volume = {4}, number = {5}, pages = {412--422}, year = {2013}, url = {https://doi.org/10.1016/j.jocs.2013.03.002}, doi = {10.1016/J.JOCS.2013.03.002}, timestamp = {Tue, 25 Feb 2020 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jocs/GroenHCNBC13.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/ploscb/KonnyuSTHMKCM13, author = {Bal{\'{a}}zs K{\"{o}}nny{\"{u}} and S. Kashif Sadiq and Tam{\'{a}}s Tur{\'{a}}nyi and Rita H{\'{\i}}rmond{\'{o}} and Barbara M{\"{u}}ller and Hans{-}Georg Kr{\"{a}}usslich and Peter V. Coveney and Viktor M{\"{u}}ller}, title = {Gag-Pol Processing during {HIV-1} Virion Maturation: {A} Systems Biology Approach}, journal = {PLoS Comput. Biol.}, volume = {9}, number = {6}, year = {2013}, url = {https://doi.org/10.1371/journal.pcbi.1003103}, doi = {10.1371/JOURNAL.PCBI.1003103}, timestamp = {Thu, 10 Sep 2020 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/ploscb/KonnyuSTHMKCM13.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/iccS/RycerzCDGGHPSZCB13, author = {Katarzyna Rycerz and Eryk Ciepiela and Grzegorz Dyk and Derek Groen and Tomasz Gubala and Daniel Harezlak and Maciej Pawlik and James J. Suter and Stefan J. Zasada and Peter V. Coveney and Marian Bubak}, editor = {Vassil Alexandrov and Michael Lees and Valeria V. Krzhizhanovskaya and Jack J. Dongarra and Peter M. A. Sloot}, title = {Support for Multiscale Simulations with Molecular Dynamics}, booktitle = {Proceedings of the International Conference on Computational Science, {ICCS} 2013, Barcelona, Spain, 5-7 June, 2013}, series = {Procedia Computer Science}, volume = {18}, pages = {1116--1125}, publisher = {Elsevier}, year = {2013}, url = {https://doi.org/10.1016/j.procs.2013.05.277}, doi = {10.1016/J.PROCS.2013.05.277}, timestamp = {Sun, 12 Nov 2023 00:00:00 +0100}, biburl = {https://dblp.org/rec/conf/iccS/RycerzCDGGHPSZCB13.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/parco/JohnsonBGBPGRFZC13, author = {Chris Johnson and Anastasia V. Bochenkova and Alexander A. Granovsky and Peter J. Bond and Teresa Paramo and Tristan Glatard and William A. Romero R. and Denis Friboulet and Stefan J. Zasada and Peter V. Coveney}, editor = {Michael Bader and Arndt Bode and Hans{-}Joachim Bungartz and Michael Gerndt and Gerhard R. Joubert and Frans J. Peters}, title = {{PRACE} {DECI} (Distributed European Computing Initiative) Minisymposium}, booktitle = {Parallel Computing: Accelerating Computational Science and Engineering (CSE), Proceedings of the International Conference on Parallel Computing, ParCo 2013, 10-13 September 2013, Garching (near Munich), Germany}, series = {Advances in Parallel Computing}, volume = {25}, pages = {805--812}, publisher = {{IOS} Press}, year = {2013}, url = {https://doi.org/10.3233/978-1-61499-381-0-805}, doi = {10.3233/978-1-61499-381-0-805}, timestamp = {Sun, 02 Oct 2022 01:00:00 +0200}, biburl = {https://dblp.org/rec/conf/parco/JohnsonBGBPGRFZC13.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/BernabeuFJNKNGHGC13, author = {Miguel O. Bernabeu and Claudio A. Franco and Martin Jones and Jens H. Nielsen and Timm Kr{\"{u}}ger and Rupert W. Nash and Derek Groen and James Hetherington and Holger Gerhardt and Peter V. Coveney}, title = {Computer simulations reveal complex distribution of haemodynamic forces in a mouse retina model of angiogenesis}, journal = {CoRR}, volume = {abs/1311.1640}, year = {2013}, url = {http://arxiv.org/abs/1311.1640}, eprinttype = {arXiv}, eprint = {1311.1640}, timestamp = {Mon, 13 Aug 2018 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/corr/BernabeuFJNKNGHGC13.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/BorgdorffMBKBCGCH13, author = {Joris Borgdorff and Mariusz Mamonski and Bartosz Bosak and Krzysztof Kurowski and Mohamed Ben Belgacem and Bastien Chopard and Derek Groen and Peter V. Coveney and Alfons G. Hoekstra}, title = {Distributed Multiscale Computing with {MUSCLE} 2, the Multiscale Coupling Library and Environment}, journal = {CoRR}, volume = {abs/1311.5740}, year = {2013}, url = {http://arxiv.org/abs/1311.5740}, eprinttype = {arXiv}, eprint = {1311.5740}, timestamp = {Mon, 13 Aug 2018 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/corr/BorgdorffMBKBCGCH13.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcisd/WanC12, author = {Shunzhou Wan and Peter V. Coveney}, title = {Regulation of {JAK2} Activation by Janus Homology 2: Evidence from Molecular Dynamics Simulations}, journal = {J. Chem. Inf. Model.}, volume = {52}, number = {11}, pages = {2992--3000}, year = {2012}, url = {https://doi.org/10.1021/ci300308g}, doi = {10.1021/CI300308G}, timestamp = {Fri, 06 Mar 2020 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jcisd/WanC12.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jocs/ZasadaWHLGCMC12, author = {Stefan J. Zasada and Tao Wang and Ali Nasrat Haidar and Enjie Liu and Norbert M. Graf and Gordon Clapworthy and Steven Manos and Peter V. Coveney}, title = {{IMENSE:} An e-infrastructure environment for patient specific multiscale data integration, modelling and clinical treatment}, journal = {J. Comput. Sci.}, volume = {3}, number = {5}, pages = {314--327}, year = {2012}, url = {https://doi.org/10.1016/j.jocs.2011.07.001}, doi = {10.1016/J.JOCS.2011.07.001}, timestamp = {Mon, 15 Jun 2020 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jocs/ZasadaWHLGCMC12.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/amia/ZasadaHC12, author = {Stefan J. Zasada and Ali Nasrat Haidar and Peter V. Coveney}, title = {A Comparative Analysis of the Usability and Legal Implications of Different Patient Data Sharing Architectures}, booktitle = {{AMIA} 2012, American Medical Informatics Association Annual Symposium, Chicago, Illinois, USA, November 3-7, 2012}, publisher = {{AMIA}}, year = {2012}, url = {https://knowledge.amia.org/amia-55142-a2012a-1.636547/t-006-1.640361/f-001-1.640362/a-281-1.640366/a-282-1.640363}, timestamp = {Wed, 04 Aug 2021 11:13:05 +0200}, biburl = {https://dblp.org/rec/conf/amia/ZasadaHC12.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/cbms/ChangZC12, author = {David Chan{-}Wei Chang and Stefan J. Zasada and Peter V. Coveney}, editor = {Paolo Soda and Francesco Tortorella and Sameer K. Antani and Mykola Pechenizkiy and Mario Cannataro and Alexey Tsymbal}, title = {The Application Hosting Environment 3.0: Simplifying biomedical simulations using RESTful web services}, booktitle = {Proceedings of {CBMS} 2012, The 25th {IEEE} International Symposium on Computer-Based Medical Systems, June 20-22, 2012, Rome, Italy}, pages = {1--4}, publisher = {{IEEE} Computer Society}, year = {2012}, url = {https://doi.org/10.1109/CBMS.2012.6266405}, doi = {10.1109/CBMS.2012.6266405}, timestamp = {Fri, 24 Mar 2023 00:00:00 +0100}, biburl = {https://dblp.org/rec/conf/cbms/ChangZC12.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/dsrt/ZasadaMGBSPKC12, author = {Stefan J. Zasada and Mariusz Mamonski and Derek Groen and Joris Borgdorff and Ilya Saverchenko and Tomasz Piontek and Krzysztof Kurowski and Peter V. Coveney}, editor = {Azzedine Boukerche and Vinny Cahill and Abdulmotaleb El{-}Saddik and Georgios Theodoropoulos and Ray Walshe}, title = {Distributed Infrastructure for Multiscale Computing}, booktitle = {16th {IEEE/ACM} International Symposium on Distributed Simulation and Real Time Applications, {DS-RT} 2012, Dublin, Ireland, October 25-27, 2012}, pages = {65--74}, publisher = {{IEEE} Computer Society}, year = {2012}, url = {https://doi.org/10.1109/DS-RT.2012.17}, doi = {10.1109/DS-RT.2012.17}, timestamp = {Thu, 23 Mar 2023 00:00:00 +0100}, biburl = {https://dblp.org/rec/conf/dsrt/ZasadaMGBSPKC12.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/efmi-stc/CoveneyS12, author = {Peter V. Coveney and Nour W. Shublaq}, editor = {Bernd Blobel and Rolf Engelbrecht and Michael A. Shifrin}, title = {Computational Biomedicine: {A} Challenge for the Twenty-First Century}, booktitle = {Large Scale Projects in eHealth - Partnership in Modernization: Proceedings of the {EFMI} Special Topic Conference, {EFMI-STC} 2012, Moscow, Russia, April 18-20, 2012}, series = {Studies in Health Technology and Informatics}, volume = {174}, pages = {105--110}, publisher = {{IOS} Press}, year = {2012}, url = {https://doi.org/10.3233/978-1-61499-052-9-105}, doi = {10.3233/978-1-61499-052-9-105}, timestamp = {Wed, 04 Mar 2020 14:10:38 +0100}, biburl = {https://dblp.org/rec/conf/efmi-stc/CoveneyS12.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/efmi-stc/ShublaqC12, author = {Nour W. Shublaq and Peter V. Coveney}, editor = {Bernd Blobel and Rolf Engelbrecht and Michael A. Shifrin}, title = {Merging Genomic and Phenomic Data for Research and Clinical Impact}, booktitle = {Large Scale Projects in eHealth - Partnership in Modernization: Proceedings of the {EFMI} Special Topic Conference, {EFMI-STC} 2012, Moscow, Russia, April 18-20, 2012}, series = {Studies in Health Technology and Informatics}, volume = {174}, pages = {111--115}, publisher = {{IOS} Press}, year = {2012}, url = {https://doi.org/10.3233/978-1-61499-052-9-111}, doi = {10.3233/978-1-61499-052-9-111}, timestamp = {Mon, 19 Feb 2018 00:00:00 +0100}, biburl = {https://dblp.org/rec/conf/efmi-stc/ShublaqC12.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/abs-1208-6444, author = {Derek Groen and Stefan J. Zasada and Peter V. Coveney}, title = {Survey of Multiscale and Multiphysics Applications and Communities}, journal = {CoRR}, volume = {abs/1208.6444}, year = {2012}, url = {http://arxiv.org/abs/1208.6444}, eprinttype = {arXiv}, eprint = {1208.6444}, timestamp = {Mon, 13 Aug 2018 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/corr/abs-1208-6444.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/abs-1209-3972, author = {Derek Groen and James Hetherington and Hywel B. Carver and Rupert W. Nash and Miguel O. Bernabeu and Peter V. Coveney}, title = {Analyzing and Modeling the Performance of the HemeLB Lattice-Boltzmann Simulation Environment}, journal = {CoRR}, volume = {abs/1209.3972}, year = {2012}, url = {http://arxiv.org/abs/1209.3972}, eprinttype = {arXiv}, eprint = {1209.3972}, timestamp = {Mon, 13 Aug 2018 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/corr/abs-1209-3972.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/abs-1210-4400, author = {Hywel B. Carver and Derek Groen and James Hetherington and Rupert W. Nash and Miguel O. Bernabeu and Peter V. Coveney}, title = {Coalesced communication: a design pattern for complex parallel scientific software}, journal = {CoRR}, volume = {abs/1210.4400}, year = {2012}, url = {http://arxiv.org/abs/1210.4400}, eprinttype = {arXiv}, eprint = {1210.4400}, timestamp = {Mon, 13 Aug 2018 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/corr/abs-1210-4400.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/abs-1211-2963, author = {Derek Groen and Joris Borgdorff and Carles Bona{-}Casas and James Hetherington and Rupert W. Nash and Stefan J. Zasada and Ilya Saverchenko and Mariusz Mamonski and Krzysztof Kurowski and Miguel O. Bernabeu and Alfons G. Hoekstra and Peter V. Coveney}, title = {Flexible composition and execution of high performance, high fidelity multiscale biomedical simulations}, journal = {CoRR}, volume = {abs/1211.2963}, year = {2012}, url = {http://arxiv.org/abs/1211.2963}, eprinttype = {arXiv}, eprint = {1211.2963}, timestamp = {Mon, 13 Aug 2018 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/corr/abs-1211-2963.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/abs-1211-5292, author = {Miguel O. Bernabeu and Rupert W. Nash and Derek Groen and Hywel B. Carver and James Hetherington and Timm Kr{\"{u}}ger and Peter V. Coveney}, title = {Choice of blood rheology model has minor impact on computational assessment of shear stress mediated vascular risk}, journal = {CoRR}, volume = {abs/1211.5292}, year = {2012}, url = {http://arxiv.org/abs/1211.5292}, eprinttype = {arXiv}, eprint = {1211.5292}, timestamp = {Mon, 13 Aug 2018 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/corr/abs-1211-5292.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/icl/HewerNC11, author = {Thomas D. Hewer and Maziar M. Nekovee and Peter V. Coveney}, title = {Universality of Performance Parameters in Vehicular ad hoc Networks}, journal = {{IEEE} Commun. Lett.}, volume = {15}, number = {9}, pages = {947--949}, year = {2011}, url = {https://doi.org/10.1109/LCOMM.2011.062911.110710}, doi = {10.1109/LCOMM.2011.062911.110710}, timestamp = {Fri, 06 Aug 2021 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/icl/HewerNC11.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcc/WanC11, author = {Shunzhou Wan and Peter V. Coveney}, title = {Molecular dynamics simulation reveals structural and thermodynamic features of kinase activation by cancer mutations within the epidermal growth factor receptor}, journal = {J. Comput. Chem.}, volume = {32}, number = {13}, pages = {2843--2852}, year = {2011}, url = {https://doi.org/10.1002/jcc.21866}, doi = {10.1002/JCC.21866}, timestamp = {Wed, 01 Apr 2020 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jcc/WanC11.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcisd/WrightC11, author = {David W. Wright and Peter V. Coveney}, title = {Resolution of Discordant {HIV-1} Protease Resistance Rankings Using Molecular Dynamics Simulations}, journal = {J. Chem. Inf. Model.}, volume = {51}, number = {10}, pages = {2636--2649}, year = {2011}, url = {https://doi.org/10.1021/ci200308r}, doi = {10.1021/CI200308R}, timestamp = {Mon, 07 Sep 2020 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jcisd/WrightC11.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jocs/ShublaqZC11, author = {Nour Shublaq and Stefan J. Zasada and Peter V. Coveney}, title = {Exciting Times in Computational Science}, journal = {J. Comput. Sci.}, volume = {2}, number = {4}, pages = {315}, year = {2011}, url = {https://doi.org/10.1016/j.jocs.2011.11.001}, doi = {10.1016/J.JOCS.2011.11.001}, timestamp = {Tue, 25 Feb 2020 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jocs/ShublaqZC11.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/eScience/GroenSC11, author = {Derek Groen and James J. Suter and Peter V. Coveney}, title = {Modelling Distributed Multiscale Simulation Performance: An Application to Nanocomposites}, booktitle = {{IEEE} 7th International Conference on E-Science, e-Science 2011, Workshop Proceedings, Stockholm, Sweden, December 5-8, 2011}, pages = {105--111}, publisher = {{IEEE} Computer Society}, year = {2011}, url = {https://doi.org/10.1109/eScienceW.2011.37}, doi = {10.1109/ESCIENCEW.2011.37}, timestamp = {Fri, 24 Mar 2023 00:00:00 +0100}, biburl = {https://dblp.org/rec/conf/eScience/GroenSC11.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/eScience/GroenZC11, author = {Derek Groen and Stefan J. Zasada and Peter V. Coveney}, title = {Taxonomy of Multiscale Computing Communities}, booktitle = {{IEEE} 7th International Conference on E-Science, e-Science 2011, Workshop Proceedings, Stockholm, Sweden, December 5-8, 2011}, pages = {120--127}, publisher = {{IEEE} Computer Society}, year = {2011}, url = {https://doi.org/10.1109/eScienceW.2011.11}, doi = {10.1109/ESCIENCEW.2011.11}, timestamp = {Fri, 24 Mar 2023 00:00:00 +0100}, biburl = {https://dblp.org/rec/conf/eScience/GroenZC11.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/tg/Kenway0HMPWCJ11, author = {Owain Kenway and David W. Wright and Helmut Heller and Andr{\'{e}} Merzky and Gavin J. Pringle and Jules Wolfrat and Peter V. Coveney and Shantenu Jha}, editor = {John Towns and Shawn Brown and Daniel S. Katz}, title = {Towards high-throughput, high-performance computational estimation of binding affinities for patient specific {HIV-1} protease sequences}, booktitle = {Proceedings of the 2011 TeraGrid Conference - Extreme Digital Discovery, {TG} '11, Salt Lake City, Utah, USA, July 18-21, 2011}, pages = {4:1--4:8}, publisher = {{ACM}}, year = {2011}, url = {https://doi.org/10.1145/2016741.2016746}, doi = {10.1145/2016741.2016746}, timestamp = {Tue, 21 Mar 2023 00:00:00 +0100}, biburl = {https://dblp.org/rec/conf/tg/Kenway0HMPWCJ11.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/tg/ZasadaGC11, author = {Stefan J. Zasada and Derek Groen and Peter V. Coveney}, editor = {John Towns and Shawn Brown and Daniel S. Katz}, title = {Developing an infrastructure to support multiscale modelling and simulation}, booktitle = {Proceedings of the 2011 TeraGrid Conference - Extreme Digital Discovery, {TG} '11, Salt Lake City, Utah, USA, July 18-21, 2011}, pages = {30:1--30:2}, publisher = {{ACM}}, year = {2011}, url = {https://doi.org/10.1145/2016741.2016773}, doi = {10.1145/2016741.2016773}, timestamp = {Sat, 09 Apr 2022 01:00:00 +0200}, biburl = {https://dblp.org/rec/conf/tg/ZasadaGC11.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/tg/ZasadaHC11, author = {Stefan J. Zasada and Ali Nasrat Haidar and Peter V. Coveney}, editor = {John Towns and Shawn Brown and Daniel S. Katz}, title = {Audited credential delegation: a usable identity management solution for grid environments}, booktitle = {Proceedings of the 2011 TeraGrid Conference - Extreme Digital Discovery, {TG} '11, Salt Lake City, Utah, USA, July 18-21, 2011}, pages = {31:1--31:2}, publisher = {{ACM}}, year = {2011}, url = {https://doi.org/10.1145/2016741.2016774}, doi = {10.1145/2016741.2016774}, timestamp = {Fri, 11 Feb 2022 00:00:00 +0100}, biburl = {https://dblp.org/rec/conf/tg/ZasadaHC11.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/cphysics/MazzeoMC10, author = {Marco D. Mazzeo and Steven Manos and Peter V. Coveney}, title = {In situ ray tracing and computational steering for interactive blood flow simulation}, journal = {Comput. Phys. Commun.}, volume = {181}, number = {2}, pages = {355--370}, year = {2010}, url = {https://doi.org/10.1016/j.cpc.2009.10.013}, doi = {10.1016/J.CPC.2009.10.013}, timestamp = {Fri, 21 Feb 2020 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/cphysics/MazzeoMC10.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/cphysics/DoctorsMC10, author = {G. M. Doctors and Marco D. Mazzeo and Peter V. Coveney}, title = {A computationally efficient method for simulating fluid flow in elastic pipes in three dimensions}, journal = {Comput. Phys. Commun.}, volume = {181}, number = {9}, pages = {1584--1592}, year = {2010}, url = {https://doi.org/10.1016/j.cpc.2010.05.012}, doi = {10.1016/J.CPC.2010.05.012}, timestamp = {Fri, 21 Feb 2020 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/cphysics/DoctorsMC10.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/ejasp/HewerNC10, author = {Thomas D. Hewer and Maziar M. Nekovee and Peter V. Coveney}, title = {Reducing Congestion in Obstructed Highways with Traffic Data Dissemination Using Ad hoc Vehicular Networks}, journal = {{EURASIP} J. Adv. Signal Process.}, volume = {2010}, year = {2010}, url = {https://doi.org/10.1155/2010/169503}, doi = {10.1155/2010/169503}, timestamp = {Fri, 06 Aug 2021 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/ejasp/HewerNC10.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/fgcs/CoveneyGJMMPSSSTZ10, author = {Peter V. Coveney and Giovanni Giupponi and Shantenu Jha and Steven Manos and Jon MacLaren and Stephen Pickles and R. S. Saksena and Thomas Soddemann and James L. Suter and Mary{-}Ann Thyveetil and Stefan J. Zasada}, title = {Large scale computational science on federated international grids: The role of switched optical networks}, journal = {Future Gener. Comput. Syst.}, volume = {26}, number = {1}, pages = {99--110}, year = {2010}, url = {https://doi.org/10.1016/j.future.2008.09.013}, doi = {10.1016/J.FUTURE.2008.09.013}, timestamp = {Thu, 20 Apr 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/fgcs/CoveneyGJMMPSSSTZ10.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/fgcs/AnnettC10, author = {James F. Annett and Peter V. Coveney}, title = {Special section: CompSci07, Computational Science 2007: Interdisciplinary challenges and perspectives, from the Grid to e-Science}, journal = {Future Gener. Comput. Syst.}, volume = {26}, number = {3}, pages = {504--505}, year = {2010}, url = {https://doi.org/10.1016/j.future.2009.10.009}, doi = {10.1016/J.FUTURE.2009.10.009}, timestamp = {Wed, 19 Feb 2020 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/fgcs/AnnettC10.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcisd/SadiqWKC10, author = {S. Kashif Sadiq and David W. Wright and Owain Kenway and Peter V. Coveney}, title = {Accurate Ensemble Molecular Dynamics Binding Free Energy Ranking of Multidrug-Resistant {HIV-1} Proteases}, journal = {J. Chem. Inf. Model.}, volume = {50}, number = {5}, pages = {890--905}, year = {2010}, url = {https://doi.org/10.1021/ci100007w}, doi = {10.1021/CI100007W}, timestamp = {Mon, 07 Sep 2020 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jcisd/SadiqWKC10.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jocs/SlootCD10, author = {Peter M. A. Sloot and Peter V. Coveney and Jack J. Dongarra}, title = {Preface}, journal = {J. Comput. Sci.}, volume = {1}, number = {1}, pages = {3--4}, year = {2010}, url = {https://doi.org/10.1016/j.jocs.2010.04.003}, doi = {10.1016/J.JOCS.2010.04.003}, timestamp = {Tue, 25 Feb 2020 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jocs/SlootCD10.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jocs/FazendeiroBCL10, author = {Luis Fazendeiro and Bruce M. Boghosian and Peter V. Coveney and Jonas L{\"{a}}tt}, title = {Unstable periodic orbits in weak turbulence}, journal = {J. Comput. Sci.}, volume = {1}, number = {1}, pages = {13--23}, year = {2010}, url = {https://doi.org/10.1016/j.jocs.2010.03.004}, doi = {10.1016/J.JOCS.2010.03.004}, timestamp = {Thu, 10 Sep 2020 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jocs/FazendeiroBCL10.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/IEEEias/HaidarZCAB10, author = {Ali Nasrat Haidar and Stefan J. Zasada and Peter V. Coveney and Ali E. Abdallah and Bruce Beckles}, title = {Audited credential delegation - a user-centric identity management solution for computational grid environments}, booktitle = {Sixth International Conference on Information Assurance and Security, {IAS} 2010, Atlanta, GA, USA, August 23-25, 2010}, pages = {222--227}, publisher = {{IEEE}}, year = {2010}, url = {https://doi.org/10.1109/ISIAS.2010.5604067}, doi = {10.1109/ISIAS.2010.5604067}, timestamp = {Wed, 16 Oct 2019 14:14:55 +0200}, biburl = {https://dblp.org/rec/conf/IEEEias/HaidarZCAB10.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/ccgrid/RiedelSRMMSLZMCWK10, author = {Morris Riedel and Bernd Schuller and Michael Rambadt and M. Shahbaz Memon and A. Shiraz Memon and Achim Streit and Thomas Lippert and Stefan J. Zasada and Steven Manos and Peter V. Coveney and Felix Wolf and Dieter Kranzlm{\"{u}}ller}, title = {Exploring the Potential of Using Multiple E-science Infrastructures with Emerging Open Standards-Based E-health Research Tools}, booktitle = {10th {IEEE/ACM} International Conference on Cluster, Cloud and Grid Computing, CCGrid 2010, 17-20 May 2010, Melbourne, Victoria, Australia}, pages = {341--348}, publisher = {{IEEE} Computer Society}, year = {2010}, url = {https://doi.org/10.1109/CCGRID.2010.96}, doi = {10.1109/CCGRID.2010.96}, timestamp = {Fri, 24 Mar 2023 00:00:00 +0100}, biburl = {https://dblp.org/rec/conf/ccgrid/RiedelSRMMSLZMCWK10.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:journals/procedia/ZasadaC10, author = {Stefan J. Zasada and Peter V. Coveney}, editor = {Peter M. A. Sloot and G. Dick van Albada and Jack J. Dongarra}, title = {Computational biomedicine: The role of workflow tools}, booktitle = {Proceedings of the International Conference on Computational Science, {ICCS} 2010, University of Amsterdam, The Netherlands, May 31 - June 2, 2010}, series = {Procedia Computer Science}, volume = {1}, number = {1}, pages = {2753--2761}, publisher = {Elsevier}, year = {2010}, url = {https://doi.org/10.1016/j.procs.2010.04.309}, doi = {10.1016/J.PROCS.2010.04.309}, timestamp = {Thu, 08 Jul 2021 14:29:22 +0200}, biburl = {https://dblp.org/rec/journals/procedia/ZasadaC10.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/cphysics/ZasadaC09, author = {Stefan J. Zasada and Peter V. Coveney}, title = {Virtualizing access to scientific applications with the Application Hosting Environment}, journal = {Comput. Phys. Commun.}, volume = {180}, number = {12}, pages = {2513--2525}, year = {2009}, url = {https://doi.org/10.1016/j.cpc.2009.06.008}, doi = {10.1016/J.CPC.2009.06.008}, timestamp = {Fri, 21 Feb 2020 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/cphysics/ZasadaC09.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/ijhpca/TrefethenHDC09, author = {Anne E. Trefethen and Nicholas J. Higham and Iain S. Duff and Peter V. Coveney}, title = {Developing a High-Performance Computing/Numerical Analysis Roadmap}, journal = {Int. J. High Perform. Comput. Appl.}, volume = {23}, number = {4}, pages = {423--426}, year = {2009}, url = {https://doi.org/10.1177/1094342009347710}, doi = {10.1177/1094342009347710}, timestamp = {Thu, 12 Mar 2020 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/ijhpca/TrefethenHDC09.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcc/WanC09, author = {Shunzhou Wan and Peter V. Coveney}, title = {A comparative study of the {COX-1} and {COX-2} isozymes bound to lipid membranes}, journal = {J. Comput. Chem.}, volume = {30}, number = {7}, pages = {1038--1050}, year = {2009}, url = {https://doi.org/10.1002/jcc.21130}, doi = {10.1002/JCC.21130}, timestamp = {Wed, 01 Apr 2020 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jcc/WanC09.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/sc/ZasadaC09, author = {Stefan J. Zasada and Peter V. Coveney}, title = {From campus resources to federated international grids: bridging the gap with the application hosting environment}, booktitle = {Proceedings of the 5th Grid Computing Environments Workshop, {GCE} 2009, November 20, 2009, Portland, Oregon, {USA}}, publisher = {{ACM}}, year = {2009}, url = {https://doi.org/10.1145/1658260.1658273}, doi = {10.1145/1658260.1658273}, timestamp = {Tue, 06 Nov 2018 00:00:00 +0100}, biburl = {https://dblp.org/rec/conf/sc/ZasadaC09.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:journals/corr/abs-1001-5050, author = {Ali Nasrat Haidar and Peter V. Coveney and Ali E. Abdallah and Peter Y. A. Ryan and Bruce Beckles and J. M. Brooke and M. A. S. Jones}, editor = {Jeremy W. Bryans and John S. Fitzgerald}, title = {Formal Modelling of a Usable Identity Management Solution for Virtual Organisations}, booktitle = {Proceedings Second Workshop on Formal Aspects of Virtual Organisations, {FAVO} 2009, Eindhoven, The Netherlands, 3rd November 2009}, series = {{EPTCS}}, volume = {16}, pages = {41--50}, year = {2009}, url = {https://doi.org/10.4204/EPTCS.16.4}, doi = {10.4204/EPTCS.16.4}, timestamp = {Sat, 19 Oct 2019 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/corr/abs-1001-5050.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/cphysics/MazzeoC08, author = {Marco D. Mazzeo and Peter V. Coveney}, title = {HemeLB: {A} high performance parallel lattice-Boltzmann code for large scale fluid flow in complex geometries}, journal = {Comput. Phys. Commun.}, volume = {178}, number = {12}, pages = {894--914}, year = {2008}, url = {https://doi.org/10.1016/j.cpc.2008.02.013}, doi = {10.1016/J.CPC.2008.02.013}, timestamp = {Fri, 21 Feb 2020 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/cphysics/MazzeoC08.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcisd/ScottMC08, author = {Daniel J. Scott and Steven Manos and Peter V. Coveney}, title = {Design of Electroceramic Materials Using Artificial Neural Networks and Multiobjective Evolutionary Algorithms}, journal = {J. Chem. Inf. Model.}, volume = {48}, number = {2}, pages = {262--273}, year = {2008}, url = {https://doi.org/10.1021/ci700269r}, doi = {10.1021/CI700269R}, timestamp = {Mon, 02 Oct 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jcisd/ScottMC08.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcisd/ScottMCRFKPAAZCYES08, author = {Daniel J. Scott and Steven Manos and Peter V. Coveney and Jeremy C. H. Rossiny and Sarah Fearn and John A. Kilner and Robert C. Pullar and Neil Mc N. Alford and A.{-}K. Axelsson and Yong Zhang and Lifeng Chen and Shoufeng Yang and Julian R. G. Evans and M. T. Sebastian}, title = {Functional Ceramic Materials Database: An Online Resource for Materials Research}, journal = {J. Chem. Inf. Model.}, volume = {48}, number = {2}, pages = {449--455}, year = {2008}, url = {https://doi.org/10.1021/ci700270v}, doi = {10.1021/CI700270V}, timestamp = {Tue, 06 Dec 2022 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jcisd/ScottMCRFKPAAZCYES08.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcisd/SadiqWWZSC08, author = {S. Kashif Sadiq and David W. Wright and Simon J. Watson and Stefan J. Zasada and Ileana Stoica and Peter V. Coveney}, title = {Automated Molecular Simulation Based Binding Affinity Calculator for Ligand-Bound {HIV-1} Proteases}, journal = {J. Chem. Inf. Model.}, volume = {48}, number = {9}, pages = {1909--1919}, year = {2008}, url = {https://doi.org/10.1021/ci8000937}, doi = {10.1021/CI8000937}, timestamp = {Sun, 12 Nov 2023 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jcisd/SadiqWWZSC08.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/healthgrid/SlootCBVNVB08, author = {Peter M. A. Sloot and Peter V. Coveney and Marian Bubak and Anne{-}Mieke Vandamme and Breannd{\'{a}}n {\'{O}} Nuall{\'{a}}in and David A. van de Vijver and Charles A. Boucher}, editor = {Tony Solomonides and Jonathan C. Silverstein and Joel H. Saltz and Yannick Legr{\'{e}} and Mary Kratz and Ian T. Foster and Vincent Breton and J. Robert Beck}, title = {Multi-Science Decision Support for {HIV} Drug Resistance Treatment}, booktitle = {Global Healthgrid: e-Science Meets Biomedical Informatics - Proceedings of HealthGrid 2008, Chicago, IL, USA, 2-4 June, 2008}, series = {Studies in Health Technology and Informatics}, volume = {138}, pages = {188--198}, publisher = {{IOS} Press}, year = {2008}, url = {http://www.booksonline.iospress.nl/Content/View.aspx?piid=9171}, timestamp = {Sat, 11 Oct 2014 19:00:55 +0200}, biburl = {https://dblp.org/rec/conf/healthgrid/SlootCBVNVB08.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/hpdc/ManosMKCKT08, author = {Steven Manos and Marco D. Mazzeo and Owain Kenway and Peter V. Coveney and Nicholas T. Karonis and Brian R. Toonen}, editor = {Manish Parashar and Karsten Schwan and Jon B. Weissman and Domenico Laforenza}, title = {Distributed mpi cross-site run performance using mpig}, booktitle = {Proceedings of the 17th International Symposium on High-Performance Distributed Computing {(HPDC-17} 2008), 23-27 June 2008, Boston, MA, {USA}}, pages = {229--230}, publisher = {{ACM}}, year = {2008}, url = {https://doi.org/10.1145/1383422.1383459}, doi = {10.1145/1383422.1383459}, timestamp = {Tue, 06 Nov 2018 00:00:00 +0100}, biburl = {https://dblp.org/rec/conf/hpdc/ManosMKCKT08.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/ercim/ZasadaGMC08, author = {Stefan J. Zasada and C. V. Gale and Steven Manos and Peter V. Coveney}, title = {Supercomputing in Clinical Practice}, journal = {{ERCIM} News}, volume = {2008}, number = {74}, year = {2008}, url = {http://ercim-news.ercim.eu/supercomputing-in-clinical-practice}, timestamp = {Wed, 22 May 2019 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/ercim/ZasadaGMC08.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/cluster/BoghosianCDFJKK07, author = {Bruce M. Boghosian and Peter V. Coveney and Suchuan Dong and Lucas Finn and Shantenu Jha and George E. Karniadakis and Nicholas T. Karonis}, title = {NEKTAR, {SPICE} and Vortonics: using federated grids for large scale scientific applications}, journal = {Clust. Comput.}, volume = {10}, number = {3}, pages = {351--364}, year = {2007}, url = {https://doi.org/10.1007/s10586-007-0029-4}, doi = {10.1007/S10586-007-0029-4}, timestamp = {Tue, 21 Mar 2023 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/cluster/BoghosianCDFJKK07.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/cphysics/CoveneySZMP07, author = {Peter V. Coveney and R. S. Saksena and Stefan J. Zasada and Mark McKeown and Stephen Pickles}, title = {The application hosting environment: Lightweight middleware for grid-based computational science}, journal = {Comput. Phys. Commun.}, volume = {176}, number = {6}, pages = {406--418}, year = {2007}, url = {https://doi.org/10.1016/j.cpc.2006.11.011}, doi = {10.1016/J.CPC.2006.11.011}, timestamp = {Fri, 21 Feb 2020 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/cphysics/CoveneySZMP07.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/hci/ClapworthyKGTVHPFMLJWC07, author = {Gordon Clapworthy and Peter Kohl and Hans Gregerson and S. R. Thomas and Marco Viceconti and D. Rodney Hose and D. Pinney and John Fenner and Keith M. McCormack and Patricia V. Lawford and Serge L. Van Sint Jan and S. Waters and Peter V. Coveney}, editor = {Vincent G. Duffy}, title = {Digital Human Modelling: {A} Global Vision and a European Perspective}, booktitle = {Digital Human Modeling, First International Conference on Digital Human Modeling, {ICDHM} 2007, Held as Part of {HCI} International 2007, Beijing, China, July 22-27, 2007, Proceedings}, series = {Lecture Notes in Computer Science}, volume = {4561}, pages = {549--558}, publisher = {Springer}, year = {2007}, url = {https://doi.org/10.1007/978-3-540-73321-8\_63}, doi = {10.1007/978-3-540-73321-8\_63}, timestamp = {Tue, 14 May 2019 10:00:43 +0200}, biburl = {https://dblp.org/rec/conf/hci/ClapworthyKGTVHPFMLJWC07.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/cphysics/CoveneyFHPP06, author = {Peter V. Coveney and Gianni De Fabritiis and Matt J. Harvey and Stephen Pickles and Andrew R. Porter}, title = {Coupled applications on distributed resources}, journal = {Comput. Phys. Commun.}, volume = {175}, number = {6}, pages = {389--396}, year = {2006}, url = {https://doi.org/10.1016/j.cpc.2006.05.008}, doi = {10.1016/J.CPC.2006.05.008}, timestamp = {Mon, 17 Apr 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/cphysics/CoveneyFHPP06.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcisd/HarveySC06, author = {Matt J. Harvey and Daniel J. Scott and Peter V. Coveney}, title = {An Integrated Instrument Control and Informatics System for Combinatorial Materials Research}, journal = {J. Chem. Inf. Model.}, volume = {46}, number = {3}, pages = {1026--1033}, year = {2006}, url = {https://doi.org/10.1021/ci050399g}, doi = {10.1021/CI050399G}, timestamp = {Sun, 01 Oct 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jcisd/HarveySC06.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/mcs/GiupponiC06, author = {Giovanni Giupponi and Peter V. Coveney}, title = {Non-Newtonian behaviour of the gyroid mesophase: {A} lattice-Boltzmann study}, journal = {Math. Comput. Simul.}, volume = {72}, number = {2-6}, pages = {124--127}, year = {2006}, url = {https://doi.org/10.1016/j.matcom.2006.05.035}, doi = {10.1016/J.MATCOM.2006.05.035}, timestamp = {Thu, 20 Apr 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/mcs/GiupponiC06.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/mcs/SerranoFEC06, author = {Mar Serrano and Gianni De Fabritiis and Pep Espa{\~{n}}ol and Peter V. Coveney}, title = {A stochastic Trotter integration scheme for dissipative particle dynamics}, journal = {Math. Comput. Simul.}, volume = {72}, number = {2-6}, pages = {190--194}, year = {2006}, url = {https://doi.org/10.1016/j.matcom.2006.05.019}, doi = {10.1016/J.MATCOM.2006.05.019}, timestamp = {Thu, 14 Oct 2021 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/mcs/SerranoFEC06.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/clade/BoghosianCDFJKK06, author = {Bruce M. Boghosian and Peter V. Coveney and Suchuan Dong and Lucas Finn and Shantenu Jha and George E. Karniadakis and Nicholas T. Karonis}, title = {NEKTAR, {SPICE} and Vortonics: using federated grids for large scale scientific applications}, booktitle = {2006 {IEEE} Challenges of Large Applications in Distributed Environments, CLADE@HPDC 2006, Paris, France, June 19, 2006}, pages = {34--42}, publisher = {{IEEE} Computer Society}, year = {2006}, url = {https://doi.org/10.1109/CLADE.2006.1652052}, doi = {10.1109/CLADE.2006.1652052}, timestamp = {Wed, 16 Oct 2019 14:14:54 +0200}, biburl = {https://dblp.org/rec/conf/clade/BoghosianCDFJKK06.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/complife/SadiqZC06, author = {S. Kashif Sadiq and Stefan J. Zasada and Peter V. Coveney}, editor = {Michael R. Berthold and Robert C. Glen and Ingrid Fischer}, title = {Grid Assisted Ensemble Molecular Dynamics Simulations of {HIV-1} Proteases Reveal Novel Conformations of the Inhibitor Saquinavir}, booktitle = {Computational Life Sciences II, Second International Symposium, CompLife 2006, Cambridge, UK, September 27-29, 2006, Proceedings}, series = {Lecture Notes in Computer Science}, volume = {4216}, pages = {150--161}, publisher = {Springer}, year = {2006}, url = {https://doi.org/10.1007/11875741\_15}, doi = {10.1007/11875741\_15}, timestamp = {Tue, 14 May 2019 10:00:36 +0200}, biburl = {https://dblp.org/rec/conf/complife/SadiqZC06.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/eScience/HarveyJTC06, author = {Matt J. Harvey and Shantenu Jha and Mary{-}Ann Thyveetil and Peter V. Coveney}, title = {Using Lambda Networks to Enhance Performance of Interactive Large Simulations}, booktitle = {Second International Conference on e-Science and Grid Technologies (e-Science 2006), 4-6 December 2006, Amsterdam, The Netherlands}, pages = {40}, publisher = {{IEEE} Computer Society}, year = {2006}, url = {https://doi.org/10.1109/E-SCIENCE.2006.261124}, doi = {10.1109/E-SCIENCE.2006.261124}, timestamp = {Fri, 24 Mar 2023 00:00:00 +0100}, biburl = {https://dblp.org/rec/conf/eScience/HarveyJTC06.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/eScience/ZasadaSCKP06, author = {Stefan J. Zasada and R. S. Saksena and Peter V. Coveney and Mark McKeown and Stephen Pickles}, title = {Facilitating User Access to the Grid: {A} Lightweight Application Hosting Environment for Grid Enabled Computational Science}, booktitle = {Second International Conference on e-Science and Grid Technologies (e-Science 2006), 4-6 December 2006, Amsterdam, The Netherlands}, pages = {50}, publisher = {{IEEE} Computer Society}, year = {2006}, url = {https://doi.org/10.1109/E-SCIENCE.2006.261134}, doi = {10.1109/E-SCIENCE.2006.261134}, timestamp = {Fri, 24 Mar 2023 00:00:00 +0100}, biburl = {https://dblp.org/rec/conf/eScience/ZasadaSCKP06.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/cphysics/HartingHCC05, author = {Jens Harting and Matt J. Harvey and Jonathan Chin and Peter V. Coveney}, title = {Detection and tracking of defects in the gyroid mesophase}, journal = {Comput. Phys. Commun.}, volume = {165}, number = {2}, pages = {97--109}, year = {2005}, url = {https://doi.org/10.1016/j.cpc.2004.10.001}, doi = {10.1016/J.CPC.2004.10.001}, timestamp = {Fri, 21 Feb 2020 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/cphysics/HartingHCC05.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/cse/BoghosianC05, author = {Bruce M. Boghosian and Peter V. Coveney}, title = {Guest Editors' Introduction: Scientific Applications of Grid Computing}, journal = {Comput. Sci. Eng.}, volume = {7}, number = {5}, pages = {10--13}, year = {2005}, url = {https://doi.org/10.1109/MCSE.2005.95}, doi = {10.1109/MCSE.2005.95}, timestamp = {Tue, 16 Aug 2022 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/cse/BoghosianC05.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/cse/ChinHJC05, author = {Jonathan Chin and Matthew J. Harvey and Shantenu Jha and Peter V. Coveney}, title = {Scientific grid computing: the first generation}, journal = {Comput. Sci. Eng.}, volume = {7}, number = {5}, pages = {24--32}, year = {2005}, url = {https://doi.org/10.1109/MCSE.2005.100}, doi = {10.1109/MCSE.2005.100}, timestamp = {Tue, 21 Mar 2023 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/cse/ChinHJC05.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/cse/BoghosianC05a, author = {Bruce M. Boghosian and Peter V. Coveney}, title = {Guest Editors' Introduction: Scientific Applications of Grid Computing, Part {II}}, journal = {Comput. Sci. Eng.}, volume = {7}, number = {6}, pages = {10--11}, year = {2005}, url = {https://doi.org/10.1109/MCSE.2005.123}, doi = {10.1109/MCSE.2005.123}, timestamp = {Tue, 16 Aug 2022 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/cse/BoghosianC05a.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcc/JhaCL05, author = {Shantenu Jha and Peter V. Coveney and Charles A. Laughton}, title = {Force field validation for nucleic acid simulations: Comparing energies and dynamics of a {DNA} dodecamer}, journal = {J. Comput. Chem.}, volume = {26}, number = {15}, pages = {1617--1627}, year = {2005}, url = {https://doi.org/10.1002/jcc.20300}, doi = {10.1002/JCC.20300}, timestamp = {Tue, 21 Mar 2023 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jcc/JhaCL05.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/sp/BlakeCCP05, author = {R. J. Blake and Peter V. Coveney and P. Clarke and Stephen Pickles}, title = {The TeraGyroid experiment - Supercomputing 2003}, journal = {Sci. Program.}, volume = {13}, number = {1}, pages = {1--17}, year = {2005}, url = {https://doi.org/10.1155/2005/435602}, doi = {10.1155/2005/435602}, timestamp = {Thu, 30 Jul 2020 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/sp/BlakeCCP05.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/sc/JhaCH05, author = {Shantenu Jha and Peter V. Coveney and Matt J. Harvey}, title = {{SPICE:} Simulated Pore Interactive Computing Environment}, booktitle = {Proceedings of the {ACM/IEEE} {SC2005} Conference on High Performance Networking and Computing, November 12-18, 2005, Seattle, WA, USA, CD-Rom}, pages = {70}, publisher = {{IEEE} Computer Society}, year = {2005}, url = {https://doi.org/10.1109/SC.2005.65}, doi = {10.1109/SC.2005.65}, timestamp = {Fri, 24 Mar 2023 00:00:00 +0100}, biburl = {https://dblp.org/rec/conf/sc/JhaCH05.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/corr/abs-cs-0501021, author = {Jens Harting and Jonathan Chin and Maddalena Venturoli and Peter V. Coveney}, title = {Large-scale lattice Boltzmann simulations of complex fluids: advances through the advent of computational grids}, journal = {CoRR}, volume = {abs/cs/0501021}, year = {2005}, url = {http://arxiv.org/abs/cs/0501021}, eprinttype = {arXiv}, eprint = {cs/0501021}, timestamp = {Mon, 13 Aug 2018 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/corr/abs-cs-0501021.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/cse/ChinCJ04, author = {Jonathan Chin and Peter V. Coveney and Shantenu Jha}, title = {The Current State of the Grid}, journal = {Comput. Sci. Eng.}, volume = {6}, number = {5}, pages = {75--77}, year = {2004}, url = {https://doi.org/10.1109/mcse.2004.43}, doi = {10.1109/MCSE.2004.43}, timestamp = {Mon, 28 Aug 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/cse/ChinCJ04.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcc/WanCF04, author = {Shunzhou Wan and Peter V. Coveney and Darren R. Flower}, title = {Large-scale molecular dynamics simulations of HLA-A*0201 complexed with a tumor-specific antigenic peptide: Can the {\(\alpha\)}3 and {\(\beta\)}2m domains be neglected?}, journal = {J. Comput. Chem.}, volume = {25}, number = {15}, pages = {1803--1813}, year = {2004}, url = {https://doi.org/10.1002/jcc.20100}, doi = {10.1002/JCC.20100}, timestamp = {Wed, 16 Mar 2022 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jcc/WanCF04.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/informaticaSI/ClementCJM99, author = {B. E. P. Clement and Peter V. Coveney and M. Jessel and Peter J. Marcer}, title = {The Brain as a Huygens Machine}, journal = {Informatica (Slovenia)}, volume = {23}, number = {3}, year = {1999}, timestamp = {Tue, 27 Jun 2017 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/informaticaSI/ClementCJM99.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/aim/CoveneyFH96, author = {Peter V. Coveney and Philip Fletcher and Trevor L. Hughes}, title = {Using Artificial Neural Networks to Predict the Quality and Performance of Oil-Field Cements}, journal = {{AI} Mag.}, volume = {17}, number = {4}, pages = {41--53}, year = {1996}, url = {https://doi.org/10.1609/aimag.v17i4.1239}, doi = {10.1609/AIMAG.V17I4.1239}, timestamp = {Tue, 25 Aug 2020 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/aim/CoveneyFH96.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@inproceedings{DBLP:conf/aaai/CoveneyHF96, author = {Peter V. Coveney and Trevor L. Hughes and Philip Fletcher}, editor = {William J. Clancey and Daniel S. Weld}, title = {Using Artificial Neural Networks to Predict the Quality and Performance of Oilfield Cements}, booktitle = {Proceedings of the Thirteenth National Conference on Artificial Intelligence and Eighth Innovative Applications of Artificial Intelligence Conference, {AAAI} 96, {IAAI} 96, Portland, Oregon, USA, August 4-8, 1996, Volume 2}, pages = {1471--1481}, publisher = {{AAAI} Press / The {MIT} Press}, year = {1996}, url = {http://www.aaai.org/Library/IAAI/1996/iaai96-275.php}, timestamp = {Tue, 05 Sep 2023 08:53:09 +0200}, biburl = {https://dblp.org/rec/conf/aaai/CoveneyHF96.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
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