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Journal of Molecular Graphics & Modelling|February 8, 2000
Solution conformation of phakellistatin 8 investigated by molecular dynamics simulationsO Galzitskaya, A CaflischCurrent Opinion in Structural Biology|November 18, 2017
Protein structure-based drug design: from docking to molecular dynamicsPaweł Śledź, Amedeo CaflischPhysical Review. E, Statistical, Nonlinear, and Soft Matter Physics|June 4, 2008
Efficient modularity optimization by multistep greedy algorithm and vertex mover refinementPhilipp Schuetz, Amedeo CaflischBioorganic & Medicinal Chemistry Letters|April 26, 2015
Current kinase inhibitors cover a tiny fraction of fragment spaceHongtao Zhao, Amedeo CaflischJournal of Chemical Information and Modeling|March 1, 2008
Fragment-based de novo ligand design by multiobjective evolutionary optimizationFabian Dey, Amedeo CaflischJournal of Medicinal Chemistry|December 8, 2006
Automatic and efficient decomposition of two-dimensional structures of small molecules for fragment-based high-throughput dockingPeter Kolb, Amedeo CaflischChemmedchem|May 28, 2009
Discovery of plasmepsin inhibitors by fragment-based docking and consensus scoringRan Friedman, Amedeo CaflischProtein Science : a Publication of the Protein Society|April 24, 2009
Activation of the West Nile virus NS3 protease: molecular dynamics evidence for a conformational selection mechanismDariusz Ekonomiuk, Amedeo CaflischJournal of Chemical Information and Modeling|December 17, 2008
Data management system for distributed virtual screeningTing Zhou, Amedeo CaflischPhysical Review. E, Statistical, Nonlinear, and Soft Matter Physics|October 15, 2008
Multistep greedy algorithm identifies community structure in real-world and computer-generated networksPhilipp Schuetz, Amedeo CaflischPageof 6,903