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在“
ACS电子期刊
”中,
命中:
51
条,耗时:0.0120248 秒
在所有数据库中总计命中:
2,246
条
1.
A Direct Method for Incorporating Experimental Data into Multiscale Coarse-Grained Models
作者:
Thomas Dannenhoffer-Lafage
;
Andrew D. White
;
Gregory A. Voth
刊名:Journal of Chemical Theory and Computation
出版年:2016
2.
Optimization of Analytical Potentials for Coarse-Grained Biopolymer Models
作者:
Paolo Mereghetti
;
Giuseppe Maccari
;
Giulia Lia Beatrice Spampinato
;
Valentina Tozzini
刊名:Journal of Physical Chemistry B
出版年:2016
3.
CSAR 2014: A Benchmark Exercise Using Unpublished Data from Pharma
作者:
Heather A. Carlson
;
Richard D. Smith
;
Kelly L. Damm-Ganamet
;
Jeanne A. Stuckey
;
Aqeel Ahmed
;
Maire A. Convery
;
Donald O. Somers
;
Michael Kranz
;
Patricia A. Elkins
;
Guanglei Cui
;
Catherine E. Peishoff
;
Millard H. Lambert
;
James B. Dunbar Jr.
刊名:Journal of Chemical Information and Modeling
出版年:2016
4.
A Rigorous and Efficient Method To Reweight Very Large Conformational Ensembles Using Average Experimental Data and To Determine Their Relative Information Content
作者:
Hoi Tik Alvin Leung
;
Olivier Bignucolo
;
Regula Aregger
;
Sonja A. Dames
;
Adam Mazur
;
Simon Bernèche
;
Stephan Grzesiek
刊名:Journal of Chemical Theory and Computation
出版年:2016
5.
Freezing Transitions of Nanoconfined Coarse-Grained Water Show Subtle Dependence on Confining Environment
作者:
Qing Lu
;
John E. Straub
刊名:Journal of Physical Chemistry B
出版年:2016
6.
Thermodynamics of the Segregation of a Kinetically Trapped Two-Dimensional Amorphous Metal–Organic Network
作者:
Sören Krotzky
;
Claudius Morchutt
;
Vijay S. Vyas
;
Bettina V. Lotsch
;
Rico Gutzler
;
Klaus Kern
刊名:Journal of Physical Chemistry C
出版年:2016
7.
Volumetrically Derived Thermodynamic Profile of Interactions of Urea with a Native Protein
作者:
Ikbae Son
;
Tigran V. Chalikian
刊名:Biochemistry
出版年:2016
8.
Estimation of Solvation
Entropy
and Enthalpy via
Analysis
of Water Oxygen鈥揌ydrogen Correlations
作者:
Camilo Velez-Vega
;
Daniel J. J. McKay
;
Tom Kurtzman
;
Vibhas Aravamuthan
;
Robert A. Pearlstein
;
Jos茅 S. Duca
刊名:Journal of Chemical Theory and Computation
出版年:2015
9.
Anchoring the Gas-Phase Acidity Scale from Hydrogen Sulfide to Pyrrole. Experimental Bond Dissociation Energies of Nitromethane, Ethanethiol, and Cyclopentadiene
作者:
Kent M. Ervin
;
Alex A. Nickel
;
Jerry G. Lanorio
;
Surja B. Ghale
刊名:Journal of Physical Chemistry A
出版年:2015
10.
Resolving Internal Motional Correlations to Complete the Conformational
Entropy
Meter
作者:
Iztok Urban膷i膷
;
Ajasja Ljubeti膷
;
Janez 艩trancar
刊名:The Journal of Physical Chemistry Letters
出版年:2014
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