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David A Case

Showing results (81-90 of 194) with videos related to

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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.
The Journal of Chemical Physics|June 10, 2016
Extracting water and ion distributions from solution x-ray scattering experimentsHung T Nguyen, Suzette A Pabit, Lois Pollack, et al.
Acta Crystallographica. Section D, Structural Biology|February 18, 2026
Validated ligand geometries for macromolecular refinement restraints and molecular-mechanics force fieldsNigel W Moriarty, David A Case, Dorothee Liebschner, et al.
Journal of the American Chemical Society|May 2, 2013
Peptide crystal simulations reveal hidden dynamicsPawel A Janowski, David S Cerutti, James Holton, et al.
Biopolymers|July 30, 2013
Biopolymers celebrates 50 years of nucleic acids researchKenneth J Breslauer, David A Case, Nils G Walter, et al.
Journal of Chemical Theory and Computation|October 21, 2014
ff14ipq: A Self-Consistent Force Field for Condensed-Phase Simulations of ProteinsDavid S Cerutti, William C Swope, Julia E Rice, et al.
Faraday Discussions|February 17, 2011
Fe-H/D stretching and bending modes in nuclear resonant vibrational, Raman and infrared spectroscopies: comparisons of density functional theory and experimentVladimir Pelmenschikov, Yisong Guo, Hongxin Wang, et al.
Journal of Chemical Theory and Computation|November 13, 2010
Generalized Born model with a simple, robust molecular volume correctionJohn Mongan, Carlos Simmerling, J Andrew McCammon, et al.
Pageof 20

Showing results (81-90 of 194) with videos related to

Sort By:
Pageof 20
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.
The Journal of Chemical Physics|June 10, 2016
Extracting water and ion distributions from solution x-ray scattering experimentsHung T Nguyen, Suzette A Pabit, Lois Pollack, et al.
Acta Crystallographica. Section D, Structural Biology|February 18, 2026
Validated ligand geometries for macromolecular refinement restraints and molecular-mechanics force fieldsNigel W Moriarty, David A Case, Dorothee Liebschner, et al.
Journal of the American Chemical Society|May 2, 2013
Peptide crystal simulations reveal hidden dynamicsPawel A Janowski, David S Cerutti, James Holton, et al.
Biopolymers|July 30, 2013
Biopolymers celebrates 50 years of nucleic acids researchKenneth J Breslauer, David A Case, Nils G Walter, et al.
Journal of Chemical Theory and Computation|October 21, 2014
ff14ipq: A Self-Consistent Force Field for Condensed-Phase Simulations of ProteinsDavid S Cerutti, William C Swope, Julia E Rice, et al.
Faraday Discussions|February 17, 2011
Fe-H/D stretching and bending modes in nuclear resonant vibrational, Raman and infrared spectroscopies: comparisons of density functional theory and experimentVladimir Pelmenschikov, Yisong Guo, Hongxin Wang, et al.
Journal of Chemical Theory and Computation|November 13, 2010
Generalized Born model with a simple, robust molecular volume correctionJohn Mongan, Carlos Simmerling, J Andrew McCammon, et al.
Pageof 20