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Date created: 2022-10-10 01:52 PM | Last Updated: 2022-10-12 03:37 PM

Identifier: DOI 10.17605/OSF.IO/CV6D2

Category: Project

Description: Models and materials for "Drug specificity and affinity are encoded in the probability of cryptic pocket opening in myosin motor domains" by Meller et al. (https://www.biorxiv.org/content/10.1101/2022.09.05.506254v1)

License: CC-By Attribution 4.0 International

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Intro

All data used to generate figures are found here. We have organized these into categories:

  • experimental-data which contains raw ATPase data from our experiments and a collection of ATPase measurements from the literature
  • tica-clustering which contains assignments files from k-means clustering in tICA-transformed dihedral feature space
  • docking which contains docking scores for an ensemble of…

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