DeepFrag 1.0.3

Ligand optimization in the browser

Brought to you by the Durrant Lab and NIH 5R01GM132353-02.

Source Code

Input Receptor and Ligand Files

This field is required! Formats: PDB, XYZ, and PQR. No hydrogen atoms required. Automatically remove all non-protein atoms?
This field is required! Formats: PDB, SDF, XYZ, and MOL2. No hydrogen atoms required.

Molecular Viewer

Missing Receptor and/or Ligand

Use the file inputs above to select the receptor and ligand PDBQT files.

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