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Tang-Qing Yu

Showing results (1-10 of 12) with videos related to

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Physical Review Letters|July 30, 2011
Temperature-accelerated method for exploring polymorphism in molecular crystals based on free energyTang-Qing Yu, Mark E Tuckerman
Proceedings of the National Academy of Sciences of the United States of America|March 5, 2015
Locating landmarks on high-dimensional free energy surfacesMing Chen, Tang-Qing Yu, Mark E Tuckerman
Dalton Transactions (Cambridge, England : 2003)|July 23, 2015
Structure modeling, synthesis and X-ray diffraction determination of an extra-large calixarene-based coordination cage and its application in drug deliveryShangchao Du, Tang-Qing Yu, Wuping Liao, et al.
Science (New York, N.Y.)|November 8, 2014
Microscopic mechanisms of equilibrium melting of a solidAmit Samanta, Mark E Tuckerman, Tang-Qing Yu, et al.
The Journal of Organic Chemistry|July 29, 2006
How to promote sluggish electrocyclization of 1,3,5-hexatrienes by captodative substitutionTang-Qing Yu, Yao Fu, Lei Liu, et al.
Proceedings of the National Academy of Sciences of the United States of America|October 5, 2016
Multiscale implementation of infinite-swap replica exchange molecular dynamicsTang-Qing Yu, Jianfeng Lu, Cameron F Abrams, et al.
Journal of Chemical Theory and Computation|May 12, 2016
Kinetics of O2 Entry and Exit in Monomeric Sarcosine Oxidase via Markovian Milestoning Molecular DynamicsAnthony Bucci, Tang-Qing Yu, Eric Vanden-Eijnden, et al.
Journal of the American Chemical Society|February 10, 2015
Full kinetics of CO entry, internal diffusion, and exit in myoglobin from transition-path theory simulationsTang-Qing Yu, Mauro Lapelosa, Eric Vanden-Eijnden, et al.
The Journal of Chemical Physics|May 3, 2014
Sampling saddle points on a free energy surfaceAmit Samanta, Ming Chen, Tang-Qing Yu, et al.
The Journal of Chemical Physics|June 9, 2014
Order-parameter-aided temperature-accelerated sampling for the exploration of crystal polymorphism and solid-liquid phase transitionsTang-Qing Yu, Pei-Yang Chen, Ming Chen, et al.
Pageof 2

Showing results (1-10 of 12) with videos related to

Sort By:
Pageof 2
Physical Review Letters|July 30, 2011
Temperature-accelerated method for exploring polymorphism in molecular crystals based on free energyTang-Qing Yu, Mark E Tuckerman
Proceedings of the National Academy of Sciences of the United States of America|March 5, 2015
Locating landmarks on high-dimensional free energy surfacesMing Chen, Tang-Qing Yu, Mark E Tuckerman
Dalton Transactions (Cambridge, England : 2003)|July 23, 2015
Structure modeling, synthesis and X-ray diffraction determination of an extra-large calixarene-based coordination cage and its application in drug deliveryShangchao Du, Tang-Qing Yu, Wuping Liao, et al.
Science (New York, N.Y.)|November 8, 2014
Microscopic mechanisms of equilibrium melting of a solidAmit Samanta, Mark E Tuckerman, Tang-Qing Yu, et al.
The Journal of Organic Chemistry|July 29, 2006
How to promote sluggish electrocyclization of 1,3,5-hexatrienes by captodative substitutionTang-Qing Yu, Yao Fu, Lei Liu, et al.
Proceedings of the National Academy of Sciences of the United States of America|October 5, 2016
Multiscale implementation of infinite-swap replica exchange molecular dynamicsTang-Qing Yu, Jianfeng Lu, Cameron F Abrams, et al.
Journal of Chemical Theory and Computation|May 12, 2016
Kinetics of O2 Entry and Exit in Monomeric Sarcosine Oxidase via Markovian Milestoning Molecular DynamicsAnthony Bucci, Tang-Qing Yu, Eric Vanden-Eijnden, et al.
Journal of the American Chemical Society|February 10, 2015
Full kinetics of CO entry, internal diffusion, and exit in myoglobin from transition-path theory simulationsTang-Qing Yu, Mauro Lapelosa, Eric Vanden-Eijnden, et al.
The Journal of Chemical Physics|May 3, 2014
Sampling saddle points on a free energy surfaceAmit Samanta, Ming Chen, Tang-Qing Yu, et al.
The Journal of Chemical Physics|June 9, 2014
Order-parameter-aided temperature-accelerated sampling for the exploration of crystal polymorphism and solid-liquid phase transitionsTang-Qing Yu, Pei-Yang Chen, Ming Chen, et al.
Pageof 2