标题: compass描述氢键问题 [打印本页] 作者Author: cgchen 时间: 2016-11-2 16:55 标题: compass描述氢键问题 各位版友好 手头一篇文章用COMPASS力场处理体系,文中提到了氢键作用,由于compass力场没有显式的氢键作用项,氢键作用是包含在非键结作用项里。审稿人提出:
1. Theprocedure how the authors included the H-bond interactions as non-bondedColumbic terms needs to be mentioned here explicitly.
2.specify howjustified this technique is.,and provide appropriate referencesof similar kind of studies which investigated these types of interactions.
我该如何解释?