比例(比率)
分子力学
量子化学
力场(虚构)
统计物理学
经典力学
物理
计算机科学
量子力学
分子动力学
分子
作者
Kenichiro Takaba,Anika J. Friedman,Chapin E. Cavender,Pavan Kumar Behara,Iván Pulido,M. Henry,Hugo MacDermott-Opeskin,Christopher R. Iacovella,Arnav Nagle,Sabrina Nordin,Michael R. Shirts,David L. Mobley,John D. Chodera,Yuanqing Wang
摘要
The development of reliable and extensible molecular mechanics (MM) forcefields—fast, empirical models characterizing the potential energy surface of molecular systems—is indispensable for biomolecular simulation and computer-aided drug design. Here, we...
科研通智能强力驱动
Strongly Powered by AbleSci AI