Articoli con mandati relativi all'accesso pubblico - Crystal N. NguyenUlteriori informazioni
Disponibili pubblicamente: 7
Grid inhomogeneous solvation theory: hydration structure and thermodynamics of the miniature receptor cucurbit [7] uril
CN Nguyen, T Kurtzman Young, MK Gilson
The Journal of chemical physics 137 (4), 2012
Mandati: US National Institutes of Health
Thermodynamics of water in an enzyme active site: grid-based hydration analysis of coagulation factor Xa
CN Nguyen, A Cruz, MK Gilson, T Kurtzman
Journal of chemical theory and computation 10 (7), 2769-2780, 2014
Mandati: US National Institutes of Health
Solvation thermodynamic mapping of molecular surfaces in AmberTools: GIST
S Ramsey, C Nguyen, R Salomon‐Ferrer, RC Walker, MK Gilson, ...
Journal of computational chemistry 37 (21), 2029-2037, 2016
Mandati: US National Institutes of Health
Testing inhomogeneous solvation theory in structure-based ligand discovery
TE Balius, M Fischer, RM Stein, TB Adler, CN Nguyen, A Cruz, MK Gilson, ...
Proceedings of the National Academy of Sciences 114 (33), E6839-E6846, 2017
Mandati: US National Institutes of Health
Spatial decomposition of translational water–water correlation entropy in binding pockets
CN Nguyen, T Kurtzman, MK Gilson
Journal of chemical theory and computation 12 (1), 414-429, 2016
Mandati: US National Institutes of Health
A molecular reconstruction approach to site-based 3D-RISM and comparison to GIST hydration thermodynamic maps in an enzyme active site
C Nguyen, T Yamazaki, A Kovalenko, DA Case, MK Gilson, T Kurtzman, ...
PLoS One 14 (7), e0219473, 2019
Mandati: US National Science Foundation, US National Institutes of Health
Parameterization of an effective potential for protein–ligand binding from host–guest affinity data
L Wickstrom, N Deng, P He, A Mentes, C Nguyen, MK Gilson, T Kurtzman, ...
Journal of Molecular Recognition 29 (1), 10-21, 2016
Mandati: US National Institutes of Health
Le informazioni sulla pubblicazione e sul finanziamento vengono stabilite automaticamente da un software