共 50 条
- [31] Enhancing virtual screening performance of protein kinases by incorporating molecular dynamics simulationsABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2016, 251Offutt, TavinaSwift, RobJusoh, Siti AzmaAmaro, Rommie
- [32] Coupling accelerated molecular dynamics methods with thermodynamic integration simulationsJOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2008, 4 (09) : 1516 - 1525de Oliveira, Cesar Augusto F.Hamelberg, DonaldMcCammon, J. Andrew
- [33] Nonholonomic Formulation of Ab Initio Molecular DynamicsJOURNAL OF ENGINEERING MATERIALS AND TECHNOLOGY-TRANSACTIONS OF THE ASME, 2017, 139 (03):Fahrenthold, Eric P.
- [34] Molecular and spin dynamics simulations using modern integration methodsAMERICAN JOURNAL OF PHYSICS, 2005, 73 (07) : 615 - 624Tsai, SHLee, HKLandau, DP
- [35] CANONICAL NUMERICAL-METHODS FOR MOLECULAR-DYNAMICS SIMULATIONSJOURNAL OF COMPUTATIONAL CHEMISTRY, 1994, 15 (01) : 72 - 79OKUNBOR, DISKEEL, RD
- [36] Coupling accelerated molecular dynamics methods with thermodynamic integration simulationsABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2009, 238de Oliveira, Cesar Augusto F.Hamelberg, DonaldMcCammon, J. Andrew
- [37] Methods for molecular dynamics simulations of protein folding/unfolding in solutionMETHODS, 2004, 34 (01) : 112 - 120Beck, DACDaggett, V
- [38] Method for solving the dynamics of multibody systems with rheonomic and nonholonomic constraintsApplied Mathematics and Mechanics (English Edition), 1996, 17 (06): : 577 - 584Shui, XiaopingZhang, Yongfa
