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41es Journées nationales de la Société Française de Médecine Périnatale (Grenoble 12-14 Octobre 2011) Rapports -- Naissance et douleur, Urgences en salle de naissance, Cardiopathies congénitales ; Exposés didactiques
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41es Journées nationales de la Société Française de Médecine Périnatale (Grenoble 12-14 Octobre 2011) Rapports -- Naissance et douleur, Urgences en salle de naissance, Cardiopathies congénitales ; Exposés didactiques

Société française de médecine périnatale. c2011

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2
Efficient multiple time scale molecular dynamics: Using colored noise thermostats to stabilize resonances
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Article
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Efficient multiple time scale molecular dynamics: Using colored noise thermostats to stabilize resonances

Morrone, Joseph A ; Markland, Thomas E ; Ceriotti, Michele ; Berne, B. J

The Journal of chemical physics, 2011-01-07, Vol.134 (1), p.014103-014103-11 [Peer Reviewed Journal]

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Spectral gap optimization of order parameters for sampling complex molecular systems
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Spectral gap optimization of order parameters for sampling complex molecular systems

Pratyush Tiwary ; B. J. Berne

Proceedings of the National Academy of Sciences - PNAS, 2016-03-15, Vol.113 (11), p.2839-2844

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Replica Exchange with Solute Scaling: A More Efficient Version of Replica Exchange with Solute Tempering (REST2)
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Replica Exchange with Solute Scaling: A More Efficient Version of Replica Exchange with Solute Tempering (REST2)

Wang, Lingle ; Friesner, Richard A ; Berne, B. J

The journal of physical chemistry. B, 2011-08-04, Vol.115 (30), p.9431-9438

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Urea denaturation by stronger dispersion interactions with proteins than water implies a 2-stage unfolding
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Urea denaturation by stronger dispersion interactions with proteins than water implies a 2-stage unfolding

Lan Hua ; Ruhong Zhou ; D. Thirumalai ; B. J. Berne

Proceedings of the National Academy of Sciences - PNAS, 2008-10-28, Vol.105 (44), p.16928-16933

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Advancing Drug Discovery through Enhanced Free Energy Calculations
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Advancing Drug Discovery through Enhanced Free Energy Calculations

Abel, Robert ; Wang, Lingle ; Harder, Edward D ; Berne, B. J ; Friesner, Richard A

Accounts of chemical research, 2017-07-18, Vol.50 (7), p.1625-1632 [Peer Reviewed Journal]

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Theory and simulations of quantum glass forming liquids
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Theory and simulations of quantum glass forming liquids

Markland, Thomas E ; Morrone, Joseph A ; Miyazaki, Kunimasa ; Berne, B J ; Reichman, David R ; Rabani, Eran

Journal of Chemical Physics, 2012-02-17, Vol.136 (7), p.074511-074511-10 [Peer Reviewed Journal]

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On achieving high accuracy and reliability in the calculation of relative protein-ligand binding affinities
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On achieving high accuracy and reliability in the calculation of relative protein-ligand binding affinities

Lingle Wang ; B. J. Berne ; Richard A. Friesner

Proceedings of the National Academy of Sciences - PNAS, 2012-01-23, Vol.109 (6), p.1937-1942

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When Does Trimethylamine N‑Oxide Fold a Polymer Chain and Urea Unfold It?
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When Does Trimethylamine N‑Oxide Fold a Polymer Chain and Urea Unfold It?

Mondal, Jagannath ; Stirnemann, Guillaume ; Berne, B. J

The journal of physical chemistry. B, 2013-07-25, Vol.117 (29), p.8723-8732

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Replica exchange with solute tempering: A method for sampling biological systems in explicit water
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Replica exchange with solute tempering: A method for sampling biological systems in explicit water

Pu Liu ; Byungchan Kim ; Richard A. Friesner ; B. J. Berne

Proceedings of the National Academy of Sciences - PNAS, 2005-09-19, Vol.102 (39), p.13749-13754

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