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1 . Academic Journal
Efficient sampling of puckering states of monosaccharides through replica exchange with solute tempering and bond softening.
저자
by
Wang, Lingle
;
Berne, B. J.
.
소스
Journal of Chemical Physics
. 8/21/2018, Vol. 149 Issue 7, pN.PAG-N.PAG. 10p. 2 Diagrams, 2 Charts, 5 Graphs.
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4 . Report
Predicting reaction coordinates in energy landscapes with diffusion anisotropy
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by
Tiwary, Pratyush
;
Berne, B. J.
.
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J. Chem. Phys. 147, 152701 (2017)
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4 . Report
How wet should be the reaction coordinate for ligand unbinding?
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by
Tiwary, Pratyush
;
Berne, B. J.
.
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4 . Report
Kramers turnover: from energy diffusion to spatial diffusion using metadynamics
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Tiwary, Pratyush
;
Berne, B. J.
.
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4 . Report
Caliber based spectral gap optimization of order parameters (SGOOP) for sampling complex molecular systems
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Tiwary, Pratyush
;
Berne, B. J.
.
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4 . Report
The role of water and steric constraints in the kinetics of cavity-ligand unbinding
저자
by
Tiwary, Pratyush
;
Mondal, Jagannath
;
Morrone, Joseph A.
;
Berne, B. J.
.
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6 . Report
Interface limited growth of heterogeneously nucleated ice in supercooled water
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Nistor, Razvan A.
;
Markland, Thomas E.
;
Berne, B. J.
.
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5 . Report
Unraveling quantum mechanical effects in water using isotopic fractionation
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Markland, Thomas E.
;
Berne, B. J.
.
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Published in PNAS May 22, 2012 vol. 109 no. 21 7988-7991
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4 . Report
When does TMAO fold a polymer chain and urea unfold it?
저자
by
Mondal, Jagannath
;
Stirnemann, Guillaume
;
Berne, B. J.
.
소스
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5 . Report
How hydrophobic drying forces impact the kinetics of molecular recognition
저자
by
Mondal, Jagannath
;
Morrone, Joseph A.
;
Berne, B. J.
.
소스
Proc. Natl. Acad. Sci. USA 110, 13277 (2013)
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