Grid Assisted Ensemble Molecular Dynamics Simulations of HIV-1 Proteases Reveal Novel Conformations of the Inhibitor Saquinavir. - S. Kashif Sadiq; Stefan J. Zasada; Peter V. Coveney (CompLife, 2006)

Facilitating User Access to the Grid: A Lightweight Application Hosting Environment for Grid Enabled Computational Science. - Stefan J. Zasada; R. S. Saksena; Peter V. Coveney; Mark McKeown; Stephen Pickles (e-Science, 2006)

The application hosting environment: Lightweight middleware for grid-based computational science. - Peter V. Coveney; R. S. Saksena; Stefan J. Zasada; Mark McKeown; Stephen Pickles (Comput. Phys. Commun., 2007)

Supercomputing in Clinical Practice. - Stefan J. Zasada; C. V. Gale; Steven Manos; Peter V. Coveney (ERCIM News, 2008)

Automated Molecular Simulation Based Binding Affinity Calculator for Ligand-Bound HIV-1 Proteases. - S. Kashif Sadiq; David W. Wright 001; Simon J. Watson 002; Stefan J. Zasada; Ileana Stoica; Peter V. Coveney (J. Chem. Inf. Model., 2008)

From campus resources to federated international grids: bridging the gap with the application hosting environment. - Stefan J. Zasada; Peter V. Coveney (SC-GCE, 2009)

Virtualizing access to scientific applications with the Application Hosting Environment. - Stefan J. Zasada; Peter V. Coveney (Comput. Phys. Commun., 2009)

Audited credential delegation - a user-centric identity management solution for computational grid environments. - Ali Nasrat Haidar; Stefan J. Zasada; Peter V. Coveney; Ali E. Abdallah; Bruce Beckles (IAS, 2010)

Exploring the Potential of Using Multiple E-science Infrastructures with Emerging Open Standards-Based E-health Research Tools. - Morris Riedel; Bernd Schuller; Michael Rambadt; M. Shahbaz Memon; A. Shiraz Memon; Achim Streit; Thomas Lippert; Stefan J. Zasada; Steven Manos; Peter V. Coveney; Felix Wolf 001; Dieter Kranzlmüller (CCGRID, 2010)

Large scale computational science on federated international grids: The role of switched optical networks. - Peter V. Coveney; Giovanni Giupponi; Shantenu Jha; Steven Manos; Jon MacLaren; Stephen Pickles; R. S. Saksena; Thomas Soddemann; James L. Suter; Mary-Ann Thyveetil; Stefan J. Zasada (Future Gener. Comput. Syst., 2010)

Computational biomedicine: The role of workflow tools. - Stefan J. Zasada; Peter V. Coveney (ICCS, 2010)

Taxonomy of Multiscale Computing Communities. - Derek Groen; Stefan J. Zasada; Peter V. Coveney (e-Science Workshops, 2011)

Developing an infrastructure to support multiscale modelling and simulation. - Stefan J. Zasada; Derek Groen; Peter V. Coveney (TG, 2011)

Audited credential delegation: a usable identity management solution for grid environments. - Stefan J. Zasada; Ali Nasrat Haidar; Peter V. Coveney (TG, 2011)

Exciting Times in Computational Science. - Nour Shublaq; Stefan J. Zasada; Peter V. Coveney (J. Comput. Sci., 2011)

A Comparative Analysis of the Usability and Legal Implications of Different Patient Data Sharing Architectures. - Stefan J. Zasada; Ali Nasrat Haidar; Peter V. Coveney (AMIA, 2012)

The Application Hosting Environment 3.0: Simplifying biomedical simulations using RESTful web services. - David Chan-Wei Chang; Stefan J. Zasada; Peter V. Coveney (CBMS, 2012)

Distributed Infrastructure for Multiscale Computing. - Stefan J. Zasada; Mariusz Mamonski; Derek Groen; Joris Borgdorff; Ilya Saverchenko; Tomasz Piontek; Krzysztof Kurowski; Peter V. Coveney (DS-RT, 2012)

Flexible composition and execution of high performance, high fidelity multiscale biomedical simulations - Derek Groen; Joris Borgdorff; Carles Bona-Casas; James Hetherington; Rupert W. Nash; Stefan J. Zasada; Ilya Saverchenko; Mariusz Mamonski; Krzysztof Kurowski; Miguel O. Bernabeu; Alfons G. Hoekstra; Peter V. Coveney (CoRR, 2012)

IMENSE: An e-infrastructure environment for patient specific multiscale data integration, modelling and clinical treatment. - Stefan J. Zasada; Tao Wang; Ali Nasrat Haidar; Enjie Liu; Norbert M. Graf; Gordon Clapworthy; Steven Manos; Peter V. Coveney (J. Comput. Sci., 2012)

Support for Multiscale Simulations with Molecular Dynamics. - Katarzyna Rycerz; Eryk Ciepiela; Grzegorz Dyk; Derek Groen; Tomasz Gubala; Daniel Harezlak; Maciej Pawlik; James J. Suter; Stefan J. Zasada; Peter V. Coveney; Marian Bubak (ICCS, 2013)

PRACE DECI (Distributed European Computing Initiative) Minisymposium. - Chris Johnson 002; Anastasia V. Bochenkova; Alexander A. Granovsky; Peter J. Bond; Teresa Paramo; Tristan Glatard; William A. Romero R.; Denis Friboulet; Stefan J. Zasada; Peter V. Coveney (PARCO, 2013)

A data infrastructure reference model with applications: towards realization of a ScienceTube vision with a data replication service. - Morris Riedel; Peter Wittenburg; Johannes Reetz; Mark van de Sanden; Jedrzej Rybicki; Benedikt von St. Vieth; Giuseppe Fiameni; Giacomo Mariani; Alberto Michelini; Claudio Cacciari; Willem Elbers; Daan Broeder; et al. (J. Internet Serv. Appl., 2013)

p-medicine: A Medical Informatics Platform for Integrated Large Scale Heterogeneous Patient Data. - J. Marés; Lev Shamardin; Gabriele Weiler; Alberto Anguita; Stelios Sfakianakis; Elias Neri; Stefan J. Zasada; Norbert M. Graf; Peter V. Coveney (AMIA, 2014)

Survey of Multiscale and Multiphysics Applications and Communities. - Derek Groen; Stefan J. Zasada; Peter V. Coveney (Comput. Sci. Eng., 2014)

Flexible composition and execution of large scale applications on distributed e-infrastructures. - Stefan J. Zasada; David Chan-Wei Chang; Ali Nasrat Haidar; Peter V. Coveney (J. Comput. Sci., 2014)

A Distributed Multi-agent Market Place for HPC Compute Cycle Resource Trading. - Stefan J. Zasada; Peter V. Coveney (CoRR, 2015)

Putting the user at the centre of the grid : simplifying usability and resource selection for high performance computing. - Stefan J. Zasada (2015)

FabSim: Facilitating computational research through automation on large-scale and distributed e-infrastructures. - Derek Groen; Agastya Bhati; James J. Suter; James Hetherington; Stefan J. Zasada; Peter V. Coveney (Comput. Phys. Commun., 2016)

Enabling Trade-offs Between Accuracy and Computational Cost: Adaptive Algorithms to Reduce Time to Clinical Insight. - Jumana Dakka; Kristof Farkas-Pall; Vivek Balasubramanian; Matteo Turilli; Shunzhou Wan; David W. Wright 001; Stefan J. Zasada; Peter V. Coveney; Shantenu Jha (CCGrid, 2018)

High-throughput binding affinity calculations at extreme scales. - Jumana Dakka; Matteo Turilli; David W. Wright 001; Stefan J. Zasada; Vivek Balasubramanian; Shunzhou Wan; Peter V. Coveney; Shantenu Jha (BMC Bioinform., 2018)

Rapid, concurrent and adaptive extreme scale binding free energy calculation. - Jumana Dakka; Kristof Farkas-Pall; Vivek Balasubramanian; Matteo Turilli; David W. Wright 001; Shunzhou Wan; Stefan J. Zasada; Peter V. Coveney; Shantenu Jha (CoRR, 2018)