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patonlab
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wSterimol
Generate Boltzmann-weighted Sterimol Steric Parameters for Conformationally-Flexible Substituents
http://patonlab.colostate.edu
MIT License
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Bump numpy from 1.14.2 to 1.22.0
#6
dependabot[bot]
opened
2 years ago
0
Trouble running the example file
#5
GKBlueBoT-sys
opened
2 years ago
2
Added default dependency to compute Sterimol parameters to DBSTEP
#4
luchini18
opened
3 years ago
0
B1 parameter is incorrect for some substituents
#3
ajs99778
opened
3 years ago
1
Error message running example
#2
gregoryprice12
closed
4 years ago
4
Issue running the example
#1
ErikCVik
closed
4 years ago
0