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PLIP: fully automated protein-ligand interaction profiler.
Salentin S, Schreiber S, Haupt VJ, Adasme MF, Schroeder M. Salentin S, et al. Among authors: haupt vj. Nucleic Acids Res. 2015 Jul 1;43(W1):W443-7. doi: 10.1093/nar/gkv315. Epub 2015 Apr 14. Nucleic Acids Res. 2015. PMID: 25873628 Free PMC article.
Discovery of Mycobacterium tuberculosis InhA Inhibitors by Binding Sites Comparison and Ligands Prediction.
Štular T, Lešnik S, Rožman K, Schink J, Zdouc M, Ghysels A, Liu F, Aldrich CC, Haupt VJ, Salentin S, Daminelli S, Schroeder M, Langer T, Gobec S, Janežič D, Konc J. Štular T, et al. Among authors: haupt vj. J Med Chem. 2016 Dec 22;59(24):11069-11078. doi: 10.1021/acs.jmedchem.6b01277. Epub 2016 Dec 12. J Med Chem. 2016. PMID: 27936766 Free PMC article.
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