Autor der Publikation

An efficient computer-aided structural elucidation strategy for mixtures using an iterative dynamic programming algorithm.

, , , , , , , und . J. Cheminformatics, 9 (1): 57:1-57:15 (2017)

Bitte wählen Sie eine Person um die Publikation zuzuordnen

Um zwischen Personen mit demselben Namen zu unterscheiden, wird der akademische Grad und der Titel einer wichtigen Publikation angezeigt. Zudem lassen sich über den Button neben dem Namen einige der Person bereits zugeordnete Publikationen anzeigen.

 

Weitere Publikationen von Autoren mit dem selben Namen

The great descriptor melting pot: mixing descriptors for the common good of QSAR models., , und . Journal of Computer-Aided Molecular Design, 26 (1): 39-43 (2012)Predictive Toxicology Modeling: Protocols for Exploring hERG Classification and Tetrahymena pyriformis End Point Predictions., , , und . Journal of Chemical Information and Modeling, 52 (6): 1660-1673 (2012)CypRules: a rule-based P450 inhibition prediction server., , , , , und . Bioinformatics, 31 (11): 1869-1871 (2015)4D-QSAR Analysis of a Series of Antifungal P450 Inhibitors and 3D-Pharmacophore Comparisons as a Function of Alignment., , , und . Journal of Chemical Information and Computer Sciences, 43 (6): 2170-2179 (2003)Rule-Based Prediction Models of Cytochrome P450 Inhibition., , , , , und . Journal of Chemical Information and Modeling, 55 (7): 1426-1434 (2015)Quantitative Structure-Based Design: Formalism and Application of Receptor-Dependent RD-4D-QSAR Analysis to a Set of Glucose Analogue Inhibitors of Glycogen Phosphorylase., , und . Journal of Chemical Information and Computer Sciences, 43 (5): 1591-1607 (2003)PgpRules: a decision tree based prediction server for P-glycoprotein substrates and inhibitors., , und . Bioinformatics, 35 (21): 4535 (2019)Categorical QSAR models for skin sensitization based on local lymph node assay measures and both ground and excited state 4D-fingerprint descriptors., , , , , , und . Journal of Computer-Aided Molecular Design, 22 (6-7): 345-366 (2008)Oversampling to Overcome Overfitting: Exploring the Relationship between Data Set Composition, Molecular Descriptors, and Predictive Modeling Methods., , , und . Journal of Chemical Information and Modeling, 53 (4): 958-971 (2013)In Silico Binary Classification QSAR Models Based on 4D-Fingerprints and MOE Descriptors for Prediction of hERG Blockage., , , , und . Journal of Chemical Information and Modeling, 50 (7): 1304-1318 (2010)