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The Journal of Physical Chemistry. B|September 24, 2010
Simulations of a protein crystal with a high resolution X-ray structure: evaluation of force fields and water modelsDavid S Cerutti, Lydia Freddolino, Robert E Duke, et al.Journal of Molecular Biology|May 19, 2018
Enhanced Sampling of Interdomain Motion Using Map-Restrained Langevin Dynamics and NMR: Application to Pin1Jill J Bouchard, Junchao Xia, David A Case, et al.The Journal of Heredity|December 13, 2006
Genetic identity of YOY bluefin tuna from the eastern and western Atlantic spawning areasJens Carlsson, Jan R McDowell, Jeanette E L Carlsson, et al.Pharmacological Reviews|December 15, 2021
Structure-Based Virtual Screening for Ligands of G Protein-Coupled Receptors: What Can Molecular Docking Do for You?Flavio Ballante, Albert J Kooistra, Stefanie Kampen, et al.Biopolymers|February 13, 2003
Free energy calculations for theophylline binding to an RNA aptamer: Comparison of MM-PBSA and thermodynamic integration methodsHiroaki Gouda, Irwin D Kuntz, David A Case, et al.The Journal of Chemical Physics|January 9, 2022
Integral equation models for solvent in macromolecular crystalsJonathon G Gray, George M Giambaşu, David A Case, et al.The American Journal of Psychology|January 16, 2004
Rules and problem solving: another lookEdmund Fantino, Beth A Jaworski, David A Case, et al.Biorxiv : the Preprint Server for Biology|August 6, 2025
Validated ligand geometries for macromolecular refinement restraints and molecular mechanics force fieldsNigel W Moriarty, David A Case, Dorothee Liebschner, et al.Bioinformatics (Oxford, England)|July 16, 2011
A Grid-enabled web portal for NMR structure refinement with AMBERIvano Bertini, David A Case, Lucio Ferella, et al.Journal of Chemical Theory and Computation|December 3, 2015
Estimation of Absolute Free Energies of Hydration Using Continuum Methods: Accuracy of Partial Charge Models and Optimization of Nonpolar ContributionsRobert C Rizzo, Tiba Aynechi, David A Case, et al.Pageof 39