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mgltools-pybabel

molecular structure file access and interpretation

Description

This package is part of the mgltools set of Python libraries which provide an infrastructure for the analysis of protein structures and their docking of chemical compounds.

The library reimplements routines of Babel v1.6 from Pat Walters and Math Stahl in Python for reading and interpreting molecular structures. It is needed by mgltools-autodocktools at runtime.

Homepage

http://mgltools.scripps.edu/


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