共 50 条
- [42] On avoiding sampling and convergence problems in alchemical binding free energy calculations ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2006, 232 : 163 - 163
- [43] Advances in conformational sampling and free energy calculations via adiabatic dynamics ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2005, 230 : U1404 - U1405
- [44] BIT_FED: An automatic sampling method for free energy calculations EUROPEAN BIOPHYSICS JOURNAL WITH BIOPHYSICS LETTERS, 2015, 44 : S150 - S150
- [45] Free energy calculations in enzymes using the paradynamics approach ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2016, 251
- [47] Enhanced Jarzynski free energy calculations using weighted ensemble JOURNAL OF CHEMICAL PHYSICS, 2020, 153 (13):
- [48] Methodologies for enhanced unbiased sampling of free energy landscapes of proteins ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2018, 256
- [49] Free energy landscape with experiment directed simulations and enhanced sampling ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2018, 256
- [50] Fast and accurate approach for binding free energy calculations for protein-ligand complexes: A Movable Type sampling method ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2015, 250