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Current Medicinal Chemistry|January 22, 2010
Towards accurate free energy calculations in ligand protein-binding studiesThomas Steinbrecher, Andreas LabahnEuropean Journal of Biochemistry|February 22, 2002
Exploring the primary electron acceptor (QA)-site of the bacterial reaction center from Rhodobacter sphaeroides. Binding mode of vitamin K derivativesOliver Hucke, Ralf Schmid, Andreas LabahnThe Journal of Physical Chemistry. B|December 27, 2005
Detecting protein-protein interactions by isotope-edited infrared spectroscopy: a numerical approachFabian Zehender, Andreas Labahn, Thorsten KoslowskiBioorganic & Medicinal Chemistry|May 8, 2012
Free energy calculations on the binding of novel thiolactomycin derivatives to E. coli fatty acid synthase IThomas Steinbrecher, David A Case, Andreas LabahnJournal of Medicinal Chemistry|March 17, 2006
A multistep approach to structure-based drug design: studying ligand binding at the human neutrophil elastaseThomas Steinbrecher, David A Case, Andreas LabahnPhysical Chemistry Chemical Physics : PCCP|February 14, 2006
Static and dynamic aspects of DNA charge transfer: a theoretical perspectiveTobias Cramer, Thomas Steinbrecher, Andreas Labahn, et al.FEBS Letters|February 1, 2003
Sequence analysis reveals new membrane anchor of reaction centre-bound cytochromes possibly related to PufXOliver Hucke, Emile Schiltz, Gerhart Drews, et al.FEBS Letters|October 22, 2002
Binding affinities and protein ligand complex geometries of nucleotides at the F(1) part of the mitochondrial ATP synthase obtained by ligand docking calculationsThomas Steinbrecher, Oliver Hucke, Stefan Steigmiller, et al.Bioorganic & Medicinal Chemistry|December 15, 2007
Bornyl (3,4,5-trihydroxy)-cinnamate--an optimized human neutrophil elastase inhibitor designed by free energy calculationsThomas Steinbrecher, Andrea Hrenn, Korinna L Dormann, et al.Planta Medica|October 7, 2006
Plant phenolics inhibit neutrophil elastaseAndrea Hrenn, Thomas Steinbrecher, Andreas Labahn, et al.Pageof 2