A common, avoidable source of error in molecular dynamics integrators.
作者信息
Lippert Ross A, Bowers Kevin J, Dror Ron O, Eastwood Michael P, Gregersen Brent A, Klepeis John L, Kolossvary Istvan, Shaw David E
出版信息
J Chem Phys. 2007 Jan 28;126(4):046101. doi: 10.1063/1.2431176.
PMID:17286520
Abstract
摘要
Zotero 插件