ZooWork Market · Skill
rowan
Cloud-based quantum chemistry platform with a Python API. Ideal for computational chemistry workflows such as pKa prediction, geometry optimization, conformer searching, molecular property calculations, protein–ligand docking (AutoDock Vina), and AI-driven protein cofolding (Chai-1, Boltz-1/2). Use it when tasks require quantum chemistry calculations, molecular property prediction, DFT or semiempirical methods, neural-network potentials (AIMNet2), protein–ligand binding predictions, or automated computational chemistry pipelines. Provides cloud compute resources with no local setup required.