conformational-analysis topic
List
conformational-analysis repositories
crest
174
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42
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CREST - A program for the automated exploration of low-energy molecular chemical space.
Sterimol
20
Stars
7
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Calculate Sterimol Parameters from Sructure Input/Output Files
wSterimol
27
Stars
10
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Generate Boltzmann-weighted Sterimol Steric Parameters for Conformationally-Flexible Substituents