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DynamicBind — Vecura
DynamicBind
Flexible protein-ligand docking via equivariant diffusion. Predicts holo receptor conformations and ranked ligand poses with binding affinities from apo or AlphaFold2 structures.
Plain list (no header)
CC(=O)Oc1ccccc1
COc1ccc(cc1)C(=O)N
CSV with header (smiles required, name optional)
smiles,name
CC(=O)Oc1ccccc1,Aspirin
Configure input settings on the left, then click "Run"
