Fix bugs in pocket module - Githubissues

volkamerlab / opencadd

A Python library for structural cheminformatics

https://opencadd.readthedocs.io

MIT License

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Fix bugs in pocket module #69

Closed dominiquesydow closed 3 years ago

dominiquesydow commented 3 years ago

Description

Work out a few bugs (and make a few improvements) in pocket module discovered while working on kissim package.

Todos

Notable points that this PR has either accomplished or will accomplish.

[x] Update local copy of structure KLIFS IDs
[x] Remove logging config from library level
[x] Rename KlifsPocket > PocketKlifs
[x] Rename BasePocket > PocketBase

Questions

None

Status

[x] Ready to go