1. Andrew Dalke
  2. fmcs


Andrew Dalke  committed 2ebded7

Changed version to v4

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Files changed (3)


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-           FMCS 1.0b3 - Find Maximum Common Substructure
+           FMCS 1.0b4 - Find Maximum Common Substructure
 Find the MCS of a group (or cluster) of chemical structures and report
 the result as a SMARTS string. It depends on RDKit cheminformatics

File fmcs.py

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 in C++ would have different tradeoffs.
-__version__ = "1.0b3"
+__version__ = "1.0b4"
 __version_info = (1, 0, 0)
 import sys

File setup.py

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 from distutils.core import setup
-      version="1.0b3",
+      version="1.0b4",
       description="Find a maximum common substructure from a set of structures using RDKit",
       author="Andrew Dalke",