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Release v1.0.0

dominiquesydow released this 27 Jul 07:23

· 29 commits to master since this release

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KinFragLib: Exploring the Kinase Inhibitor Space Using Subpocket-Focused Fragmentation and Recombination.

This is the code base used to generate data for the KinFragLib paper submitted to ChemRxiv and JCIM on 2020-07-23:

Manuscript: https://chemrxiv.org/s/2c0fb3a743dec8994fc0
Data GitHub repository: https://github.com/volkamerlab/KinFragLib/releases/tag/v1.0.0

Assets 2