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https://github.com/adam-maz/sift-based_ligand-target_analysis
Here I am sharing a package containing scripts for SIFt analysis. These tools enable the user to compare the SIFts of docked ligands with a averaged reference SIFt by calculating the Tanimoto coefficients.
https://github.com/adam-maz/sift-based_ligand-target_analysis
maestro-schrodinger python regex sift-descriptors structure-based-drug-design tanimoto-coefficient
Last synced: 1 day ago
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Here I am sharing a package containing scripts for SIFt analysis. These tools enable the user to compare the SIFts of docked ligands with a averaged reference SIFt by calculating the Tanimoto coefficients.
- Host: GitHub
- URL: https://github.com/adam-maz/sift-based_ligand-target_analysis
- Owner: Adam-maz
- Created: 2024-05-28T22:03:34.000Z (7 months ago)
- Default Branch: main
- Last Pushed: 2024-06-05T10:37:32.000Z (7 months ago)
- Last Synced: 2024-11-09T12:06:27.220Z (about 2 months ago)
- Topics: maestro-schrodinger, python, regex, sift-descriptors, structure-based-drug-design, tanimoto-coefficient
- Language: Python
- Homepage:
- Size: 23.4 KB
- Stars: 0
- Watchers: 1
- Forks: 0
- Open Issues: 0
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Metadata Files: