Johannes Schwöbel

Publication Activity (10 Years)

Years Active: 2009-2015
Publications (10 Years): 1

Top Topics

Inductive Databases

Knowledge Discovery

Structural Features

Top Venues

J. Cheminformatics

J. Chem. Inf. Model.

Publications

Chihae Yang, Aleksey Tarkhov, Jörg Marusczyk, Bruno Bienfait, Johann Gasteiger, Thomas Kleinöder, Tomasz Magdziarz, Oliver Sacher, Christof H. Schwab, Johannes Schwöbel, Lothar Terfloth, Kirk Arvidson, Ann Richard, Andrew P. Worth, James Rathman
New Publicly Available Chemical Query Language, CSRML, To Support Chemotype Representations for Application to Data Mining and Modeling. J. Chem. Inf. Model. 55 (3) (2015)
Johannes Schwöbel, Bruno Bienfait, Johann Gasteiger, Thomas Kleinöder, Jörg Marusczyk, Oliver Sacher, Christof H. Schwab, Aleksey Tarkhov, Lothar Terfloth, Mark T. D. Cronin
Quantifying intrinsic chemical reactivity of molecular structural features for protein binding and reactive toxicity, using the MOSES chemoinformatics system. J. Cheminformatics 4 (S-1) (2012)
Johannes Schwöbel, Judith C. Madden, Mark T. D. Cronin
Application of a chemical reactivity database to predict toxicity for reactive mechanisms. J. Cheminformatics 3 (S-1) (2011)
Johannes Schwöbel, Ralf-Uwe Ebert, Ralph Kühne, Gerrit Schüürmann
Modeling the H bond donor strength of -OH, -NH, and -CH sites by local molecular parameters. J. Comput. Chem. 30 (9) (2009)
Johannes Schwöbel, Ralf-Uwe Ebert, Ralph Kühne, Gerrit Schüürmann
Prediction of the Intrinsic Hydrogen Bond Acceptor Strength of Organic Compounds by Local Molecular Parameters. J. Chem. Inf. Model. 49 (4) (2009)