Johannes Schwöbel

According to our database, Johannes Schwöbel authored at least 5 papers between 2009 and 2015.

Collaborative distances:

• Dijkstra number of six.
• Erdős number of four.

2015

New Publicly Available Chemical Query Language, CSRML, To Support Chemotype Representations for Application to Data Mining and Modeling.

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

J. Chem. Inf. Model., 2015

2012

Quantifying intrinsic chemical reactivity of molecular structural features for protein binding and reactive toxicity, using the MOSES chemoinformatics system.

Johannes Schwöbel, Bruno Bienfait, Johann Gasteiger, Thomas Kleinöder, Jörg Marusczyk, Oliver Sacher, Christof H. Schwab, Aleksey Tarkhov, Lothar Terfloth, Mark T. D. Cronin

J. Cheminformatics, 2012

2011

Application of a chemical reactivity database to predict toxicity for reactive mechanisms.

Johannes Schwöbel, Judith C. Madden, Mark T. D. Cronin

J. Cheminformatics, 2011

2009

Prediction of the Intrinsic Hydrogen Bond Acceptor Strength of Organic Compounds by Local Molecular Parameters.

Johannes Schwöbel, Ralf-Uwe Ebert, Ralph Kühne, Gerrit Schüürmann

J. Chem. Inf. Model., 2009

Modeling the H bond donor strength of -OH, -NH, and -CH sites by local molecular parameters.

Johannes Schwöbel, Ralf-Uwe Ebert, Ralph Kühne, Gerrit Schüürmann

J. Comput. Chem., 2009