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Molecular Informatics|August 3, 2016
Pharmacophore Alignment Search Tool (PhAST): Significance Assessment of Chemical SimilarityVolker Hähnke, Matthias Rupp, Alexander K Hartmann, et al.Chemistry Central Journal|September 21, 2007
Predicting olfactory receptor neuron responses from odorant structureMichael Schmuker, Marien de Bruyne, Melanie Hähnel, et al.Proteomics|January 15, 2009
Form follows function: shape analysis of protein cavities for receptor-based drug designMartin Weisel, Ewgenij Proschak, Jan M Kriegl, et al.Biodrugs : Clinical Immunotherapeutics, Biopharmaceuticals and Gene Therapy|February 1, 2007
Structure-based virtual screening of FGFR inhibitors: cross-decoys and induced-fit effectObdulia Rabal, Gisbert Schneider, Jose I Borrell, et al.Angewandte Chemie (International Ed. in English)|July 24, 2015
Revealing the Macromolecular Targets of Fragment-Like Natural ProductsTiago Rodrigues, Daniel Reker, Jens Kunze, et al.Molecular Informatics|September 20, 2016
Scoring of de novo Designed Chemical Entities by Macromolecular Target PredictionAlexander L Button, Jan A Hiss, Petra Schneider, et al.Chemmedchem|September 6, 2018
MetScore: Site of Metabolism Prediction Beyond Cytochrome P450 EnzymesArndt R Finkelmann, Daria Goldmann, Gisbert Schneider, et al.Journal of Computer-Aided Molecular Design|April 8, 2004
Comparison of correlation vector methods for ligand-based similarity searchingUli Fechner, Lutz Franke, Steffen Renner, et al.Journal of Computational Chemistry|September 15, 2010
Pharmacophore alignment search tool: Influence of canonical atom labeling on similarity searchingVolker Hähnke, Matthias Rupp, Mireille Krier, et al.Planta Medica|February 27, 2015
Chemography of natural product spaceTomoyuki Miyao, Daniel Reker, Petra Schneider, et al.Pageof 34