selected publications
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academic article
- ChemProt-3.0: a global chemical biology diseases mapping.. Database : the journal of biological databases and curation. 2016:-. 2016
- Discovery of a novel selective PPARĪ³ ligand with partial agonist binding properties by integrated in silico/in vitro work flow.. Journal of chemical information and modeling. 53:923-937. 2013
- ChemProt-2.0: visual navigation in a disease chemical biology database.. Nucleic acids research. :-. 2012
- Of possible cheminformatics futures.. Journal of computer-aided molecular design. 26:107-112. 2012
- Associating Drugs, Targets and Clinical Outcomes into an Integrated Network Affords a New Platform for Computer-Aided Drug Repurposing.. Molecular informatics. 30:100-111. 2011
- ChemProt: a disease chemical biology database.. Nucleic acids research. 39:D367-D372. 2011
- hERG classification model based on a combination of support vector machine method and GRIND descriptors.. Molecular pharmaceutics. 5:117-127.