2018-04-25 16:24:25 The following is my notes about the GROMACS Soft-Core Potential for Free Energy Calculation Theory The soft-core potential between two states A and B is defined as V s c ( r ) = ( 1 − λ ) ...
Thomas E. Cheatham III, Daniel R. Roe Rodrigo Galindo-Murillo, AMBER 2015伦敦学术沙龙 分析入门: 主成分分析简介 原始文档 2018-04-04 21:25:04 翻译: 席昆(武汉大学) 本教程将使用 CPPTRAJ 中的主成分分析(PCA, principal component analysis )来研究序列为 d(GCACGAACGAACGAACGC) 的3 ...