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DrrDom
crem

CReM: chemically reasonable mutations framework

3K 268 44
mcsorkun
chemplot

A python package for chemical space visualization.

1K 152 35
ale94mleon
moldrug

moldrug (AKA mouse) is a Python package for drug-oriented optimization on the chemical space ​

975 39 7
AspirinCode
qrci

A Quantitative Ring Complexity Index for Profiling Ring Topology and Chemical Diversity

194 10 2
gmattedi
chemicalspace

Object-oriented Representation for Chemical Spaces

90 2 0
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