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Disambiguation of "Case, David A."

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ff14ipq: A Self-Consistent Force Field for Condensed-Phase Simulations of Proteins

, , , and . Journal of Chemical Theory and Computation, 10 (10): 4515-4534 (2014)PMID: 25328495.
DOI: 10.1021/ct500643c

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lin A David

David A Traill

David A Wuttke

David A Lazica

Hugh Casey

 

Other publications of authors with the same name

Energetic Selection of Topology in Ferredoxins., , , , and . PLoS Comput. Biol., (2012)Converging free energy estimates: MM-PB(GB)SA studies on the protein-protein complex Ras-Raf., and . J. Comput. Chem., 25 (2): 238-250 (2004)Erratum to: Lessons learned from comparing molecular dynamics engines on the SAMPL5 dataset., , , , , , , and . J. Comput. Aided Mol. Des., 31 (8): 777 (2017)X-ray Crystallography Module in MD Simulation Program Amber 2023. Refining the Models of Protein Crystals., , , , and . J. Chem. Inf. Model., 64 (1): 18-25 (January 2024)Sucrose in aqueous solution revisited, Part 2: Adaptively biased molecular dynamics simulations and computational analysis of NMR relaxation, and . Biopolymers, 97 (5): 289--302 (2012)ff14ipq: A Self-Consistent Force Field for Condensed-Phase Simulations of Proteins, , , and . Journal of Chemical Theory and Computation, 10 (10): 4515-4534 (2014)PMID: 25328495.AMBER, a package of computer programs for applying molecular mechanics, normal mode analysis, molecular dynamics and free energy calculations to simulate the structural and energetic properties of molecules, , , , , , , , and . Computer Physics Communications, 91 (1-3): 1--41 (1995)A Grid-enabled web portal for NMR structure refinement with AMBER., , , , and . Bioinform., 27 (17): 2384-2390 (2011)A comparison of quantum chemical models for calculating NMR shielding parameters in peptides: Mixed basis set and ONIOM methods combined with a complete basis set extrapolation., and . J. Comput. Chem., 27 (7): 825-836 (2006)Invited Talk: Macromolecular Simulations Using Continuum Solvent Models.. German Conference on Bioinformatics, volume P-71 of LNI, page 145. GI, (2005)