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README.md

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 # LigBoundConf 2.0
 
-LigBoundConf is a set of high-quality drug-like bound ligand structures in the Protein Data Bank (PDB). The original set contains three sets 
+[LigBoundConf](https://pubs.acs.org/doi/full/10.1021/acs.jcim.0c01197) is a set of high-quality drug-like bound ligand structures in the Protein Data Bank (PDB). The original set contains three sets 
 of structures: "raw” structures taken directly from the PDB, "bound” structures, obtained by performing a local minimization of the ligand 
 in the presence of the protein pocket with an empirical force field, and “global minimum” structures, obtained by finding the lowest energy 
 conformation of the ligand with an empirical force field and implicit water solvation model.