Ecosyste.ms: Packages
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spack.io : gnina
gnina (pronounced NEE-na) is a molecular docking program with integrated support for scoring and optimizing ligands using convolutional neural networks.
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Source
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purl: pkg:spack/gnina
Keywords: cheminformatics, computational-chemistry, convolutional-neural-networks, drug-discovery, molecular-modeling
License: Other
Latest release: about 1 year ago
First release: about 1 year ago
Stars: 394 on GitHub
Forks: 125 on GitHub
See more repository details: repos.ecosyste.ms
Last synced: 3 days ago