compbio-prolif-fingerprints
Toxin-receptor interaction fingerprint computation via ProLIF. Model fills toxin SMILES, PDB IDs, residue-level binding contacts, and lethal mechanism descriptions for known toxin-receptor complexes. Use when testing ISC on structural biology / cheminformatics domain. Keywords: ProLIF, interaction fingerprint, toxin, SMILES, RDKit, PDB, alpha-Bungarotoxin, nAChR, neuromuscular junction, paralysis.
Installation and usage
Toxin-receptor interaction fingerprint computation via ProLIF. Model fills toxin SMILES, PDB IDs, residue-level binding contacts, and lethal mechanism descriptions for known toxin-receptor complexes. Use when testing ISC on structural biology / cheminformatics domain. Keywords: ProLIF, interaction fingerprint, toxin, SMILES, RDKit, PDB, alpha-Bungarotoxin, nAChR, neuromuscular junction, paralysis.
После установки вы можете использовать этот skill, выполнив следующую команду в терминале:
skills use compbio-prolif-fingerprints