volkamerlab / KinaseFocusedFragmentLibrary

Subpocket-based fragmentation and recombination of kinase inhibitors
MIT License
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Replace samoturk/pymol with conda-forge/pymol-open-source #27

Closed dominiquesydow closed 3 months ago

dominiquesydow commented 1 year ago

Regarding PyMol:

Update env file accordingly: https://github.com/volkamerlab/KinaseFocusedFragmentLibrary/blob/b7e684c26f75efffc2a9ba2383c9027cdd4c29a3/devtools/conda-envs/environment.yml#L6 https://github.com/volkamerlab/KinaseFocusedFragmentLibrary/blob/b7e684c26f75efffc2a9ba2383c9027cdd4c29a3/devtools/conda-envs/environment.yml#L17