gnina
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Showing 8 of 8 repositories
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- libmolgrid Public
Comprehensive library for fast, GPU accelerated molecular gridding for deep learning workflows
- phinder Public
Semi-automatic identification of pharmacophore features from unbound receptor structure using gnina fragment docking
- scripts Public
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- SolTranNet Public
Implementation of the SolTranNet tool utilizing the molecular transformer to predict aqueous solubility
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