Xponge.analysis
SPONGE 1.4 的 Xponge API 文档。¶ Xponge.analysis
This package gives functions and classes for analysis
¶ subpackages
¶ submodules
¶ Xponge.analysis.md_analysis
¶ Xponge.analysis.sasa
¶ Xponge.analysis.wham
¶ functions
¶ classes
¶ MdoutReader
This class is used to read the mdout file generated by SPONGE
| parameters | explanation |
|---|---|
| filename | the name of the mdout file |