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文件信息

文件大小
4,887,964 字节
MD5
45f70ae3c229159a997528089538a342

项目描述

cclib is an open source library, written in Python, for parsing and interpreting the results of computational chemistry packages. It currently parses output files from ADF, Firefly, GAMESS, GAMESS-UK, Gaussian, Jaguar and ORCA.