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surface_analyses
surface_analyses PublicScores for Hydrophobicity and Charges based on SASAs
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GetContacts_analysis
GetContacts_analysis PublicAnalysis tool for GetContact Frequencies
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- practical_course_bachelor Public
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- gist-tutorial Public
GIST Tutorial published in the Living Journal of Computational Molecular Science
- gisttools Public
Post-processing of data generated by the GIST (Grid Inhomogeneous Solvation Theory) action in cpptraj
- X-Entropy Public
This package is meant to calculate the dihedral entropy of a biomolecule. However, it can also calculate the entropy of any binnable data or simply the KDE of that data.
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