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rasbt

Hbind

rasbt/Hbind

Calculates hydrogen-bond interaction tables for protein-small molecule complexes, based on protein PDB and protonated ligand MOL2 structure input. Raschka et al. (2018) J. Computer-Aided Molec. Design

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1.1 MB
CApache License 2.0
bioinformaticscomputational-biologydata-sciencehydrogen-bondsprotein-ligand-interfaces
Created: Oct 20, 2017
Updated: Jul 2, 2025
Last push: Nov 6, 2019