Prepare single ligands or SDF libraries for AutoDock Vina with Meeko while preserving chemical identity, state, atom mapping, validation decisions, and provenance.
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Why Some Ligands Fail Before AutoDock Vina: A Practical SDF Preflight Checklist
An SDF file can load and still be unfit for docking. Diagnose valence, aromaticity, fragments, stereochemistry, hydrogens, 3D geometry, minimization, and PDBQT failures before AutoDock Vina.