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Journal of Medicinal Chemistry|June 6, 2013
VAMMPIRE: a matched molecular pairs database for structure-based drug design and optimizationJulia Weber, Janosch Achenbach, Daniel Moser, et al.Journal of Chemical Information and Modeling|January 29, 2015
VAMMPIRE-LORD: a web server for straightforward lead optimization using matched molecular pairsJulia Weber, Janosch Achenbach, Daniel Moser, et al.Bioorganic & Medicinal Chemistry Letters|February 8, 2017
DrugBank screening revealed alitretinoin and bexarotene as liver X receptor modulatorsPascal Heitel, Janosch Achenbach, Daniel Moser, et al.Bioorganic & Medicinal Chemistry Letters|September 29, 2012
Evaluation of structure-derived pharmacophore of soluble epoxide hydrolase inhibitors by virtual screeningDaniel Moser, Janosch Achenbach, Franca-Maria Klingler, et al.Journal of Chemical Information and Modeling|January 28, 2015
PENG: a neural gas-based approach for pharmacophore elucidation. method design, validation, and virtual screening for novel ligands of LTA4HDaniel Moser, Sandra K Wittmann, Jan Kramer, et al.Future Medicinal Chemistry|June 29, 2011
Computational tools for polypharmacology and repurposingJanosch Achenbach, Pekka Tiikkainen, Lutz Franke, et al.Biochemical Pharmacology|March 15, 2012
Investigation of imatinib and other approved drugs as starting points for antidiabetic drug discovery with FXR modulating activityRamona Steri, Janosch Achenbach, Dieter Steinhilber, et al.ACS Medicinal Chemistry Letters|June 6, 2014
Dual-target virtual screening by pharmacophore elucidation and molecular shape filteringDaniel Moser, Joanna M Wisniewska, Steffen Hahn, et al.Toxicology Letters|January 23, 2016
Synthetic cannabinoids: In silico prediction of the cannabinoid receptor 1 affinity by a quantitative structure-activity relationship modelAlexander Paulke, Ewgenij Proschak, Kai Sommer, et al.ACS Omega|August 29, 2019
A Diverse Benchmark Based on 3D Matched Molecular Pairs for Validating Scoring FunctionsLena Kalinowsky, Julia Weber, Shantheya Balasupramaniam, et al.Pageof 26