标题: acpype命令出现错误 [打印本页] 作者Author: 陈小黑啊啊啊 时间: 2022-3-18 12:57 标题: acpype命令出现错误 我正在学习分子模拟。在采用acpype.py文件计算时遇到命令错误如下:
[root@localhost 3]# ./acpype.py -i AC-.mol2 -c user
============================================================================
| ACPYPE: AnteChamber PYthon Parser interfacE v. 0 0 Rev: 0 (c) 2022 AWSdS |
============================================================================
WARNING: no 'babel' executable, no PDB file as input can be used!
ACPYPE FAILED: [Errno 2] No such file or directory: 'tmp'
Total time of execution: less than a second