标题: psf文件出错 [打印本页] 作者Author: wweng 时间: 2016-4-14 19:58 标题: psf文件出错 出错原因Reason: FATAL ERROR: Structure (psf) file is either in CHARMM format (with numbers for atoms types, the X-PLOR format using names is required) or the segment name field is empty.
Charm++ fatal error:
FATAL ERROR: Structure (psf) file is either in CHARMM format (with numbers for atoms types, the X-PLOR format using names is required) or the segment name field is empty.