Chemical shifts in biomolecules

per Case, David A.
Publicat 2013

Using quantum chemistry to estimate chemical shifts in biomolecules

per Case, David A.
Publicat a Biophys Chem (2020)

The delay-reduction hypothesis of conditioned reinforcement and punishment: Observing behavior

per Case, David A., Fantino, Edmund
Publicat 1981

Human observing: Maintained by stimuli correlated with reinforcement but not extinction

per Fantino, Edmund, Case, David A.
Publicat 1983

Calculation of Chemical Shift Anisotropy in Proteins

per Tang, Sishi, Case, David A.
Publicat 2011

Multi-Level Ewald: A hybrid multigrid / Fast Fourier Transform approach to the electrostatic particle—mesh problem

per Cerutti, David S., Case, David A.
Publicat 2010

Evaluation of DNA Force Fields in Implicit Solvation

per Gaillard, Thomas, Case, David A.
Publicat 2011

Sucrose in Aqueous Solution Revisited: 1. Molecular Dynamics Simulations and Direct and Indirect Dipolar Coupling Analysis

per Xia, Junchao, Case, David A.
Publicat 2011

Sucrose in Aqueous Solution Revisited: 2. Adaptively Biased Molecular Dynamics Simulations and Computational Analysis of NMR Relaxation

per Xia, Junchao, Case, David A.
Publicat 2011

Molecular Dynamics Simulations of Macromolecular Crystals

per Cerutti, David S., Case, David A.
Publicat a Wiley Interdiscip Rev Comput Mol Sci (2018)

Multiscale modeling of nucleic acids: insights into DNA flexibility

per Bomble, Yannick J., Case, David A.
Publicat 2008

Twenty-five years of nucleic acid simulations

per Cheatham, Thomas E., Case, David A.
Publicat 2013

Generalized Born Implicit Solvent Models for Biomolecules

per Onufriev, Alexey V., Case, David A.
Publicat a Annu Rev Biophys (2019)

Atomistic simulations of heme dissociation pathways in human methemoglobins reveal hidden intermediates

per Samuel, Premila P., Case, David A.
Publicat a Biochemistry (2020)

A novel method for finding tRNA genes

per TSUI, VICKIE, MACKE, TOM, CASE, DAVID A.
Publicat 2003

Ligand-bound S = 1/2 FeMo-Cofactor of Nitrogenase: Hyperfine Interaction Analysis and Implication for the Central Ligand X Identity

per Pelmenschikov, Vladimir, Case, David A., Noodleman, Louis
Publicat 2008

Direct simulation of electron transfer reactions in DNA radical cations

per Steinbrecher, Thomas, Koslowski, Thorsten, Case, David A.
Publicat 2008

Influence of the coupling of interdomain and overall motions on NMR relaxation

per Wong, Vance, Case, David A., Szabo, Attila
Publicat 2009

Soft-Core Potentials in Thermodynamic Integration. Comparing One- and Two-Step Transformations

per Steinbrecher, Thomas, Joung, In Suk, Case, David A.
Publicat 2011

Simple electrolyte solutions: Comparison of DRISM and molecular dynamics results for alkali halide solutions

per Joung, In Suk, Luchko, Tyler, Case, David A.
Publicat 2013