https://github.com/rdk/p2rank

P2Rank: Protein-ligand binding site prediction tool based on machine learning. Stand-alone command line program / Java library for predicting ligand binding pockets from protein structure.
https://github.com/rdk/p2rank

binding-sites bioinformatics drug-discovery groovy java ligand machine-learning mmcif molecular-structures p2rank pdb protein-ligand-docking protein-ligand-interactions protein-structure protein-surface proteins pymol random-forest structural-bioinformatics virtual-screening

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P2Rank: Protein-ligand binding site prediction tool based on machine learning. Stand-alone command line program / Java library for predicting ligand binding pockets from protein structure.

• Host: GitHub
• URL: https://github.com/rdk/p2rank
• Owner: rdk
• License: mit
• Created: 2016-09-25T23:46:28.000Z (over 8 years ago)
• Default Branch: develop
• Last Pushed: 2024-10-25T17:51:10.000Z (3 months ago)
• Last Synced: 2024-10-30T02:37:35.344Z (3 months ago)
• Topics: binding-sites, bioinformatics, drug-discovery, groovy, java, ligand, machine-learning, mmcif, molecular-structures, p2rank, pdb, protein-ligand-docking, protein-ligand-interactions, protein-structure, protein-surface, proteins, pymol, random-forest, structural-bioinformatics, virtual-screening
• Language: Groovy
• Homepage: https://rdk.github.io/p2rank/
• Size: 666 MB
• Stars: 246
• Watchers: 9
• Forks: 34
• Open Issues: 14
• Metadata Files:
  • Readme: README.md
  • License: LICENSE.txt

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