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Journal of Biomolecular NMR|August 3, 2015
AFNMR: automated fragmentation quantum mechanical calculation of NMR chemical shifts for biomoleculesJason Swails, Tong Zhu, Xiao He, et al.Journal of the American Chemical Society|January 12, 2019
Predicting Site-Binding Modes of Ions and Water to Nucleic Acids Using Molecular Solvation TheoryGeorge M Giambaşu, David A Case, Darrin M YorkJournal of the American Chemical Society|April 17, 2008
Carbon-deuterium bonds as probes of dihydrofolate reductaseMegan C Thielges, David A Case, Floyd E RomesbergJournal of the American Chemical Society|July 3, 2003
Structural, spectroscopic, and redox consequences of a central ligand in the FeMoco of nitrogenase: a density functional theoretical studyTimothy Lovell, Tiqing Liu, David A Case, et al.Biophysical Journal|November 23, 2021
Simulations of Kindlin-2 PIP binding domains reveal protonation-dependent membrane binding modesRobert D Palmere, David A Case, Andrew J NieuwkoopJournal of Biological Inorganic Chemistry : JBIC : a Publication of the Society of Biological Inorganic Chemistry|August 31, 2002
FeMo cofactor of nitrogenase: energetics and local interactions in the protein environmentTimothy Lovell, Jian Li, David A Case, et al.Journal of Molecular Biology|January 22, 2008
Characterization of domain-peptide interaction interface: a case study on the amphiphysin-1 SH3 domainTingjun Hou, Wei Zhang, David A Case, et al.RNA (New York, N.Y.)|March 26, 2015
Structural fidelity and NMR relaxation analysis in a prototype RNA hairpinGeorge M Giambaşu, Darrin M York, David A CaseInternational Journal of Molecular Sciences|September 9, 2020
Application of Various Molecular Modelling Methods in the Study of Estrogens and XenoestrogensAnna Helena Mazurek, Łukasz Szeleszczuk, Thomas Simonson, et al.Journal of Chemical Information and Modeling|August 27, 2013
Complementarity between in silico and biophysical screening approaches in fragment-based lead discovery against the A(2A) adenosine receptorDan Chen, Anirudh Ranganathan, Adriaan P IJzerman, et al.Pageof 39