Current Topics in Medicinal Chemistry

Graphical Abstracts:
pp. i-iv(4)

Editorial (Thematic Issue: Drug Metabolism, Toxicology Experimental Determination and Theoretical Prediction: Challenges and Perspectives from a Medicinal Chemistry Point of View)
pp. 1323-1324(2)
Authors: H. Andrade, Carolina; C. Braga, Rodolpho

In Vitro Human Hepatocyte-Based Experimental Systems for the Evaluation of Human Drug Metabolism, Drug-Drug Interactions, and Drug Toxicity in Drug Development
pp. 1325-1338(14)
Author: P. Li, Albert

QM/MM Modelling of Drug-Metabolizing Enzymes
pp. 1339-1347(9)
Authors: Lonsdale, Richard; J. Mulholland, Adrian

Ritonavir Analogues as a Probe for Deciphering the Cytochrome P450 3A4 Inhibitory Mechanism
pp. 1348-1355(8)
Authors: F. Sevrioukova, Irina; L. Poulos, Thomas

Integrative Approaches for Predicting In Vivo Effects of Chemicals from their Structural Descriptors and the Results of Short-Term Biological Assays
pp. 1356-1364(9)
Authors: Sia Low, Yen; Yeugenyevich Sedykh, Alexander; Rusyn, Ivan; Tropsha, Alexander

Prediction of Cytochrome P450 Mediated Metabolism of Designer Drugs
pp. 1365-1373(9)
Authors: Marie Nielsen, Line; Linnet, Kristian; Olsen, Lars; Rydberg, Patrik

Mutagenicity of N-oxide Containing Heterocycles and Related Compounds: Experimental and Theoretical Studies
pp. 1374-1387(14)
Authors: Gabay, Martin; Cabrera, Mauricio; Di Maio, Rossanna; A. Paez, Juan; Campillo, Nuria; L. Lavaggi, Maria; Cerecetto, Hugo; Gonzalez, Mercedes

In Vitro Microsomal Hepatic Metabolism of Antiasthmatic Prototype LASSBio-448
pp. 1388-1398(11)
Authors: Karine Costa Nunes, Isabelle; Wanderley Tinoco, Luzineide; Martins-Junior, Helvecio; Rezende, Claudia; J. Barreiro, Eliezer; Moreira Lima, Lidia

Tuning hERG Out: Antitarget QSAR Models for Drug Development
pp. 1399-1415(17)
Authors: C. Braga, Rodolpho; M. Alves, Vinicius; F.B. Silva, Meryck; Muratov, Eugene; Fourches, Denis; Tropsha, Alexander; H. Andrade, Carolina

In Memory of Patrik Rydberg
pp. 1416-1416(1)
Author: Olsen, Lars