共 50 条
- [41] Unified quantum mechanical approach to macromolecular simulations: From a single electron to fully solvated proteins ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2011, 241
- [42] Point-charge force field for molecular mechanics simulations of proteins based on condensed-phase quantum mechanical calculations. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2003, 225 : U755 - U755
- [45] Toward a general neural network force field for protein simulations: Refining the intramolecular interaction in protein JOURNAL OF CHEMICAL PHYSICS, 2023, 159 (02):
- [48] Effect of scaling of a quantum mechanical force field on the frequencies and forms of molecular vibrations Journal of Structural Chemistry, 1998, 39 : 169 - 174