Blind Docking

2 papers with code • 1 benchmarks • 1 datasets

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Datasets


Most implemented papers

EquiBind: Geometric Deep Learning for Drug Binding Structure Prediction

HannesStark/EquiBind 7 Feb 2022

Predicting how a drug-like molecule binds to a specific protein target is a core problem in drug discovery.

DiffDock: Diffusion Steps, Twists, and Turns for Molecular Docking

gcorso/diffdock 4 Oct 2022

Predicting the binding structure of a small molecule ligand to a protein -- a task known as molecular docking -- is critical to drug design.