共 50 条
- [43] Constraints on the phase diagram of molybdenum from first-principles free-energy calculations PHYSICAL REVIEW B, 2012, 85 (06):
- [45] PHYS 198-Advances in using free-energy calculations for molecular design ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2009, 237
- [46] Using free-energy calculations to optimize chloroalkane force-field parameters BIOMACROMOLECULES: FROM 3-D STRUCTURE TO APPLICATIONS, 1997, : 183 - 192
- [48] PROPELLANT EVALUATIONS BY FREE-ENERGY MINIMIZATION THROUGH RANDOM SEARCH PROPELLANTS AND EXPLOSIVES, 1977, 2 (05): : 94 - 97
- [50] CONFORMATIONAL SUBSTATES AND UNCERTAINTY IN MACROMOLECULAR FREE-ENERGY CALCULATIONS JOURNAL OF PHYSICAL CHEMISTRY, 1993, 97 (13): : 3409 - 3417