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wSterimol: Generate Boltzmann-weighted Sterimol Steric Parameters for Conformationally-Flexible Substituents

Brethomé, Alexandre; Fletcher, Stephen P.; Paton, Robert S.

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@software{brethome_alexandre_2018_1434440,
  author       = {Brethomé, Alexandre and
                  Fletcher, Stephen P. and
                  Paton, Robert S.},
  title        = {{wSterimol: Generate Boltzmann-weighted Sterimol 
                   Steric Parameters for Conformationally-Flexible
                   Substituents}},
  month        = sep,
  year         = 2018,
  publisher    = {Zenodo},
  version      = {v.1.0.3},
  doi          = {10.5281/zenodo.1434440},
  url          = {https://doi.org/10.5281/zenodo.1434440}
}
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Publication date:
September 24, 2018
DOI:
10.5281/zenodo.1434440

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10.5281/zenodo.1434440

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Keyword(s):
sterimol steric parameters cheminformatics pymol plugin physical organic chemistry
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License (for files):
MIT License

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Version v.1.0.3 10.5281/zenodo.1434440 Sep 24, 2018
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