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Ryan Bitetti-Putzer

Showing results (1-10 of 4) with videos related to

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The Journal of Chemical Physics|July 23, 2004
Free energy simulations: use of reverse cumulative averaging to determine the equilibrated region and the time required for convergenceWei Yang, Ryan Bitetti-Putzer, Martin Karplus
The Journal of Chemical Physics|July 23, 2004
Chaperoned alchemical free energy simulations: a general method for QM, MM, and QM/MM potentialsWei Yang, Ryan Bitetti-Putzer, Martin Karplus
The Journal of Chemical Physics|May 13, 2006
Conformational sampling via a self-regulating effective energy surfaceRyan Bitetti-Putzer, Aaron R Dinner, Wei Yang, et al.
The Journal of Chemical Physics|April 21, 2007
Synergistic approach to improve "alchemical" free energy calculation in rugged energy surfaceDonghong Min, Hongzhi Li, Guohui Li, et al.
Pageof 1

Showing results (1-10 of 4) with videos related to

Sort By:
Pageof 1
The Journal of Chemical Physics|July 23, 2004
Free energy simulations: use of reverse cumulative averaging to determine the equilibrated region and the time required for convergenceWei Yang, Ryan Bitetti-Putzer, Martin Karplus
The Journal of Chemical Physics|July 23, 2004
Chaperoned alchemical free energy simulations: a general method for QM, MM, and QM/MM potentialsWei Yang, Ryan Bitetti-Putzer, Martin Karplus
The Journal of Chemical Physics|May 13, 2006
Conformational sampling via a self-regulating effective energy surfaceRyan Bitetti-Putzer, Aaron R Dinner, Wei Yang, et al.
The Journal of Chemical Physics|April 21, 2007
Synergistic approach to improve "alchemical" free energy calculation in rugged energy surfaceDonghong Min, Hongzhi Li, Guohui Li, et al.
Pageof 1