Garrett M. Morris

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Arthur OlsonProfesssor The Scripps Research InstitutePatvirtintas el. paštas scripps.edu
David S. GoodsellThe Scripps Research InstitutePatvirtintas el. paštas scripps.edu
Richard K. BelewEmeritus professor, UCSDPatvirtintas el. paštas ucsd.edu
Michel SannerProfessor of Computational Biology at Scripps Research La Jolla CAPatvirtintas el. paštas scripps.edu
William E HartSandia National LaboratoriesPatvirtintas el. paštas sandia.gov
Charlotte DeaneProfessor of Structural Bioinformatics, Oxford UniversityPatvirtintas el. paštas stats.ox.ac.uk
Paul William FinnOxford Drug Design Limited, University of Buckingham, Affinity Drug DesignPatvirtintas el. paštas oxforddrugdesign.com
Philip C. BigginProfessor of Computational Biochemistry, University of OxfordPatvirtintas el. paštas bioch.ox.ac.uk
Michael B. ZwickDepartment of Immunology and Microbiology, The Scripps Research InstitutePatvirtintas el. paštas scripps.edu
ParrenLeiden University Medical CenterPatvirtintas el. paštas lumc.nl
raymond dwekoxford glycobiology institutePatvirtintas el. paštas exeter.ox.ac.uk
Ralph PantophletAssociate Professor, Simon Fraser UniversityPatvirtintas el. paštas sfu.ca
Erica Ollmann SaphireLa Jolla Institute for ImmunologyPatvirtintas el. paštas lji.org
Geoffrey HutchisonProfessor of Chemistry, University of PittsburghPatvirtintas el. paštas pitt.edu
Chi-Huey WongThe Scripps Research Institute; Academia SinicaPatvirtintas el. paštas gate.sinica.edu.tw
Stefano ForliScripps Research, Dep. Integrative Structural Computational Biology @ForliLabPatvirtintas el. paštas scripps.edu
Prof. Jean-Paul EbejerUniversity of MaltaPatvirtintas el. paštas um.edu.mt
Carlos OuteiralEric and Wendy Schmidt AI in Science Postdoctoral FellowPatvirtintas el. paštas stats.ox.ac.uk
Lucian ChanAstex PharmaceuticalsPatvirtintas el. paštas astx.com
Stuart ArmstrongJames Martin Research Fellow, Future of Humanity Institute, Oxford UniversityPatvirtintas el. paštas buildaligned.ai

Stebėti

Garrett M. Morris

University of Oxford

Patvirtintas el. paštas stats.ox.ac.uk

Computational Chemistry Computer-Aided Drug Design Virtual Screening Docking Machine Learning & AI


Pavadinimas Rūšiuoti pagal šaltinius Rūšiuoti pagal metus Rūšiuoti pagal pavadinimą	Cituota Cituota	Metai
AutoDock4 and AutoDockTools4: Automated Docking with Selective Receptor Flexibility GM Morris, R Huey, W Lindstrom, MF Sanner, RK Belew, DS Goodsell, ... J. Comput. Chem. 30 (16), 2785-2791, 2009	23444	2009
Automated docking using a Lamarckian genetic algorithm and an empirical binding free energy function GM Morris, DS Goodsell, RS Halliday, R Huey, WE Hart, RK Belew, ... J. Comput. Chem. 19, 1639, 1998	13271	1998
A semiempirical free energy force field with charge‐based desolvation R Huey, GM Morris, AJ Olson, DS Goodsell Journal of computational chemistry 28 (6), 1145-1152, 2007	2608	2007
Automated docking of flexible ligands: applications of AutoDock DS Goodsell, GM Morris, AJ Olson Journal of Molecular Recognition 9 (1), 1-5, 1996	2042	1996
Distributed automated docking of flexible ligands to proteins: parallel applications of AutoDock 2.4 GM Morris, DS Goodsell, R Huey, AJ Olson Journal of computer-aided molecular design 10 (4), 293-304, 1996	1364	1996
Molecular Docking GM Morris, M Lim-Wilby Molecular Modeling of Proteins, 365-382, 2008	1292	2008
Using AutoDock for Ligand‐Receptor Docking GM Morris, R Huey, AJ Olson Current Protocols in Bioinformatics, 8.14. 1-8.14. 40, 2008	1189	2008
Crystal structure of a neutralizing human IGG against HIV-1: a template for vaccine design EO Saphire, PWHI Parren, R Pantophlet, MB Zwick, GM Morris, PM Rudd, ... Science 293 (5532), 1155-1159, 2001	1153	2001
Automated docking to multiple target structures: incorporation of protein mobility and structural water heterogeneity in AutoDock F Österberg, GM Morris, MF Sanner, AJ Olson, DS Goodsell Proteins: Structure, Function, and Bioinformatics 46 (1), 34-40, 2002	649	2002
Using AutoDock 4 and AutoDock Vina with AutoDockTools: A Tutorial R Huey, GM Morris, S Forli The Scripps Research Institute Molecular Graphics Laboratory, 2012	459	2012
Target flexibility: an emerging consideration in drug discovery and design P Cozzini, GE Kellogg, F Spyrakis, DJ Abraham, G Costantino, A Emerson, ... Journal of medicinal chemistry 51 (20), 6237-6255, 2008	378	2008
The prospects of quantum computing in computational molecular biology C Outeiral, M Strahm, J Shi, GM Morris, SC Benjamin, CM Deane Wiley Interdisciplinary Reviews: Computational Molecular Science 11 (1), e1481, 2021	253	2021
Freely Available Conformer Generation Methods: How Good Are They? JP Ebejer, GM Morris, CM Deane Journal of chemical information and modeling 52 (5), 1146-1158, 2012	248	2012
Rapid and Accurate Prediction and Scoring of Water Molecules in Protein Binding Sites GA Ross, GM Morris, PC Biggin PloS one 7 (3), e32036, 2012	224	2012
Active site binding modes of curcumin in HIV-1 protease and integrase O Vajragupta, P Boonchoong, GM Morris, AJ Olson Bioorganic & medicinal chemistry letters 15 (14), 3364-3368, 2005	172	2005
Using AutoDock with AutoDockTools: A Tutorial R Huey, GM Morris La Jolla, CA: The Scripps Research Institute, Molecular Graphics Laboratory, 2008	169	2008
PoseBusters: AI-based docking methods fail to generate physically valid poses or generalise to novel sequences M Buttenschoen, GM Morris, CM Deane Chemical Science 15 (9), 3130-3139, 2024	155	2024
Automated docking of ligands to an artificial active site: augmenting crystallographic analysis with computer modeling RJ Rosenfeld, DS Goodsell, RA Musah, GM Morris, DB Goodin, AJ Olson Journal of Computer-Aided Molecular Design 17, 525-536, 2003	123	2003
ElectroShape: fast molecular similarity calculations incorporating shape, chirality and electrostatics MS Armstrong, GM Morris, PW Finn, R Sharma, L Moretti, RI Cooper, ... Journal of computer-aided molecular design 24 (9), 789-801, 2010	120	2010
Learning from the ligand: using ligand-based features to improve binding affinity prediction F Boyles, CM Deane, GM Morris Bioinformatics 36 (3), 758-764, 2020	103	2020

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