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Journal of Computer-Aided Molecular Design|August 7, 2012
Using halogen bonds to address the protein backbone: a systematic evaluationRainer Wilcken, Markus O Zimmermann, Andreas Lange, et al.Journal of Chemical Information and Modeling|January 11, 2019
Scaffold Effects on Halogen Bonding StrengthAndreas Lange, Johannes Heidrich, Markus O Zimmermann, et al.Journal of Chemical Information and Modeling|October 6, 2015
pROC-Chemotype Plots Enhance the Interpretability of Benchmarking Results in Structure-Based Virtual ScreeningTamer M Ibrahim, Matthias R Bauer, Alexander Dörr, et al.Journal of Medicinal Chemistry|November 14, 2012
Principles and applications of halogen bonding in medicinal chemistry and chemical biologyRainer Wilcken, Markus O Zimmermann, Andreas Lange, et al.Journal of Chemical Information and Modeling|July 6, 2016
Using Surface Scans for the Evaluation of Halogen Bonds toward the Side Chains of Aspartate, Asparagine, Glutamate, and GlutamineMarkus O Zimmermann, Andreas Lange, Stefan Zahn, et al.Journal of Chemical Theory and Computation|November 26, 2015
Addressing Methionine in Molecular Design through Directed Sulfur-Halogen BondsRainer Wilcken, Markus O Zimmermann, Andreas Lange, et al.Cellular Signalling|November 15, 2011
Intramolecular signaling in tandem-GAF domains from PDE5 and PDE10 studied with a cyanobacterial adenylyl cyclase reporterAna Banjac, Markus O Zimmermann, Frank M Boeckler, et al.Frontiers in Chemistry|November 3, 2018
Switching Between Bicyclic and Linear Peptides - The Sulfhydryl-Specific Linker TPSMB Enables Reversible Cyclization of PeptidesChristoph Ernst, Johannes Heidrich, Catharina Sessler, et al.Frontiers in Chemistry|November 30, 2020
Supporting SARS-CoV-2 Papain-Like Protease Drug Discovery: <i>In silico</i> Methods and BenchmarkingTamer M Ibrahim, Muhammad I Ismail, Matthias R Bauer, et al.Plos Computational Biology|January 24, 2014
Machine learning estimates of natural product conformational energiesMatthias Rupp, Matthias R Bauer, Rainer Wilcken, et al.Pageof 7