Skill
diffdock-nim
Created by nvidia
Version 392ab8ab2587345a9d86240967f666bd59ac82ca
Overview
Run DiffDock molecular docking via NVIDIA NIM to predict small-molecule binding poses against protein targets. Use for DiffDock, molecular docking, ligand docking, blind docking, SMILES or SDF ligands, ranked poses, confidence scores, hosted NVIDIA API, or local Docker deployment.