torsions

There are 0 repository under torsions topic.

• choderalab / torsionfit

  Bayesian tools for fitting molecular mechanics torsion parameters to quantum chemical data.

  bayesian-inferencensf-grant-che-1738979forcefieldtorsionsforce-fieldforcefield-parameterizationuncertainty-quantification
  Language:Rich Text Format 19

• monogenics / code

  mathematicsmonogenicstorsions
  Language:Python 1