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Journal of Molecular Biology|July 10, 2003
Insights into protein-protein binding by binding free energy calculation and free energy decomposition for the Ras-Raf and Ras-RalGDS complexesHolger Gohlke, Christina Kiel, David A CaseJournal of Molecular Biology|December 25, 2002
Structural details, pathways, and energetics of unfolding apomyoglobinAlexey Onufriev, David A Case, Donald BashfordJournal 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 LabahnInorganic Chemistry|June 27, 2008
Ligand-bound S = 1/2 FeMo-cofactor of nitrogenase: hyperfine interaction analysis and implication for the central ligand X identityVladimir Pelmenschikov, David A Case, Louis NoodlemanBiochemistry|September 5, 2015
Dynamic Water-Mediated Hydrogen Bonding in a Collagen Model PeptideIwen Fu, David A Case, Jean BaumThe Journal of General Virology|September 20, 2022
Potential origins of fish toti-like viruses in invertebratesAndrew J Tighe, Neil M Ruane, Jens CarlssonBiochemistry|January 31, 2020
Energy Landscapes Reveal Agonist Control of G Protein-Coupled Receptor Activation via MicroswitchesOliver Fleetwood, Pierre Matricon, Jens Carlsson, et al.Journal of Fish Diseases|May 27, 2025
Comparing Genome Sequencing Methods to Reconstruct the Spread of Piscine Myocarditis Virus in IrelandAndrew J Tighe, Jens Carlsson, Neil M RuaneJournal of Chemical Theory and Computation|November 27, 2015
Charges for Large Scale Binding Free Energy Calculations with the Linear Interaction Energy MethodGöran Wallin, Martin Nervall, Jens Carlsson, et al.The Journal of Physical Chemistry. B|June 28, 2006
Continuum solvation models in the linear interaction energy methodJens Carlsson, Martin Andér, Martin Nervall, et al.Pageof 39