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York, Darrin
311
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Online (311)
Mediatypes
Articles (Online) (179)
Bookchapter (Online) (1)
OpenAccess-fulltext (131)
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1
A Comparison of QM/MM Simulations with and without the Drud..:
König, Gerhard
;
Pickard, Frank
;
Huang, Jing
...
Molecules. 23 (2018) 10 - p. 2695 , 2018
Link:
https://doi.org/10.3390/..
?
2
Heavy atom labeled nucleotides for measurement of kinetic i..:
Weissman, Benjamin P.
;
Li, Nan-Sheng
;
York, Darrin
..
Biochimica et Biophysica Acta (BBA) - Proteins and Proteomics. 1854 (2015) 11 - p. 1737-1745 , 2015
Link:
https://doi.org/10.1016/..
?
3
Experimental and computational evidence that ribonuclease A..:
Harris, Michael E
;
Gu, Hong
;
Wong, Kin‐Yu
...
The FASEB Journal. 27 (2013) S1 - p. , 2013
Link:
https://doi.org/10.1096/..
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4
Hybrid Methods of Molecular Modeling:
York, Darrin
Journal of the American Chemical Society. 131 (2009) 42 - p. 15565-15566 , 2009
Link:
https://doi.org/10.1021/..
?
5
Description of Phosphate Hydrolysis Reactions with the Self..:
Yang, Yang
;
Yu, Haibo
;
York, Darrin
..
Journal of Chemical Theory and Computation. 4 (2008) 12 - p. 2067-2084 , 2008
Link:
https://doi.org/10.1021/..
?
6
Extension of the Self-Consistent-Charge Density-Functional ..:
Yang, Yang
;
Yu, Haibo
;
York, Darrin
..
The Journal of Physical Chemistry A. 111 (2007) 42 - p. 10861-10873 , 2007
Link:
https://doi.org/10.1021/..
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7
Normal Modes of Redox-Active Tyrosine: Conformation Depend..:
Range, Kevin
;
Ayala, Idelisa
;
York, Darrin
.
The Journal of Physical Chemistry B. 110 (2006) 22 - p. 10970-10981 , 2006
Link:
https://doi.org/10.1021/..
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8
Spectroscopic Properties of Tyrosyl Radicals in Dipeptides:
Ayala, Idelisa
;
Range, Kevin
;
York, Darrin
.
Journal of the American Chemical Society. 124 (2002) 19 - p. 5496-5505 , 2002
Link:
https://doi.org/10.1021/..
?
9
The fast Fourier Poisson method for calculating Ewald sums:
York, Darrin
;
Yang, Weitao
The Journal of Chemical Physics. 101 (1994) 4 - p. 3298-3300 , 1994
Link:
https://doi.org/10.1063/..
?
10
Particle mesh Ewald: An N⋅log(N) method for Ewald sums in l..:
Darden, Tom
;
York, Darrin
;
Pedersen, Lee
The Journal of Chemical Physics. 98 (1993) 12 - p. 10089-10092 , 1993
Link:
https://doi.org/10.1063/..
?
11
Amber free energy tools: Interoperable software for free en..:
Tao, Yujun
;
Giese, Timothy J.
;
Ekesan, Şölen
...
The Journal of Chemical Physics. 160 (2024) 22 - p. , 2024
Link:
https://doi.org/10.1063/..
?
12
Surface-Accelerated String Method for Locating Minimum Free..:
Giese, Timothy J.
;
Ekesan, Şölen
;
McCarthy, Erika
..
Journal of Chemical Theory and Computation. , 2024
Link:
https://doi.org/10.1021/..
?
13
Electronic and Nuclear Quantum Effects on Proton Transfer R..:
Tao, Yujun
;
Giese, Timothy J.
;
York, Darrin M.
Molecules. 29 (2024) 11 - p. 2703 , 2024
Link:
https://doi.org/10.3390/..
?
14
Adsorption of Flavonoids in a Transcriptional Regulator Ttg..:
Wu, Yuxuan
;
Zhang, Shi
;
York, Darrin M.
.
The Journal of Physical Chemistry B. 128 (2024) 27 - p. 6529-6541 , 2024
Link:
https://doi.org/10.1021/..
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15
Software Infrastructure for Next-Generation QM/MM−ΔMLP Forc..:
Giese, Timothy J.
;
Zeng, Jinzhe
;
Lerew, Lauren
...
The Journal of Physical Chemistry B. 128 (2024) 26 - p. 6257-6271 , 2024
Link:
https://doi.org/10.1021/..
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