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Multiscale Modeling of Biological Functions: From Enzymes to Molecular Machines (Nobel Lecture)
Multiscale Modeling of Biological Functions: From Enzymes to Molecular Machines (Nobel Lecture)
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Multiscale Modeling of Biological Functions: From Enzymes to Molecular Machines (Nobel Lecture)

Warshel, Arieh

Angewandte Chemie (International ed.), 2014-09, Vol.53 (38), p.10020-10031 [Periódico revisado por pares]

Weinheim: WILEY-VCH Verlag

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Enzyme millisecond conformational dynamics do not catalyze the chemical step
Enzyme millisecond conformational dynamics do not catalyze the chemical step
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Enzyme millisecond conformational dynamics do not catalyze the chemical step

Pisliakov, Andrei V ; Cao, Jie ; Kamerlin, Shina C.L ; Warshel, Arieh

Proceedings of the National Academy of Sciences - PNAS, 2009-10, Vol.106 (41), p.17359-17364 [Periódico revisado por pares]

United States: National Academy of Sciences

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3
Reexamining the origin of the directionality of myosin V
Reexamining the origin of the directionality of myosin V
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Reexamining the origin of the directionality of myosin V

Alhadeff, Raphael ; Warshel, Arieh

Proceedings of the National Academy of Sciences - PNAS, 2017-09, Vol.114 (39), p.10426-10431 [Periódico revisado por pares]

United States: National Academy of Sciences

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4
Demonstrating aspects of multiscale modeling by studying the permeation pathway of the human ZnT2 zinc transporter
Demonstrating aspects of multiscale modeling by studying the permeation pathway of the human ZnT2 zinc transporter
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Demonstrating aspects of multiscale modeling by studying the permeation pathway of the human ZnT2 zinc transporter

Golan, Yarden ; Alhadeff, Raphael ; Glaser, Fabian ; Ganoth, Assaf ; Warshel, Arieh ; Assaraf, Yehuda G Papoian, Garegin A.

PLoS computational biology, 2018-11, Vol.14 (11), p.e1006503 [Periódico revisado por pares]

United States: Public Library of Science

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5
Coarse-grained (multiscale) simulations in studies of biophysical and chemical systems
Coarse-grained (multiscale) simulations in studies of biophysical and chemical systems
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Coarse-grained (multiscale) simulations in studies of biophysical and chemical systems

Kamerlin, Shina C L ; Vicatos, Spyridon ; Dryga, Anatoly ; Warshel, Arieh

Annual review of physical chemistry, 2011-01, Vol.62 (1), p.41-64 [Periódico revisado por pares]

United States: Annual Reviews, Inc

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6
A new class of α-ketoamide derivatives with potent anticancer and anti-SARS-CoV-2 activities
A new class of α-ketoamide derivatives with potent anticancer and anti-SARS-CoV-2 activities
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A new class of α-ketoamide derivatives with potent anticancer and anti-SARS-CoV-2 activities

Wang, Juan ; Liang, Boqiang ; Chen, Yiling ; Fuk-Woo Chan, Jasper ; Yuan, Shuofeng ; Ye, Hui ; Nie, Linlin ; Zhou, Jiao ; Wu, Yi ; Wu, Meixian ; Huang, Lina S. ; An, Jing ; Warshel, Arieh ; Yuen, Kwok-Yung ; Ciechanover, Aaron ; Huang, Ziwei ; Xu, Yan

European journal of medicinal chemistry, 2021-04, Vol.215, p.113267-113267, Article 113267 [Periódico revisado por pares]

France: Elsevier Masson SAS

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7
Realistic simulation of the activation of voltage-gated ion channels
Realistic simulation of the activation of voltage-gated ion channels
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Realistic simulation of the activation of voltage-gated ion channels

Dryga, Anatoly ; Chakrabarty, Suman ; Vicatos, Spyridon ; Warshel, Arieh

Proceedings of the National Academy of Sciences - PNAS, 2012-02, Vol.109 (9), p.3335-3340 [Periódico revisado por pares]

United States: National Academy of Sciences

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8
Perspective: Defining and quantifying the role of dynamics in enzyme catalysis
Perspective: Defining and quantifying the role of dynamics in enzyme catalysis
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Perspective: Defining and quantifying the role of dynamics in enzyme catalysis

Warshel, Arieh ; Bora, Ram Prasad

The Journal of chemical physics, 2016-05, Vol.144 (18), p.180901-180901 [Periódico revisado por pares]

United States: American Institute of Physics

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9
A Chemical Strategy for the Degradation of the Main Protease of SARS-CoV‑2 in Cells
A Chemical Strategy for the Degradation of the Main Protease of SARS-CoV‑2 in Cells
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A Chemical Strategy for the Degradation of the Main Protease of SARS-CoV‑2 in Cells

Sang, Xiaohong ; Wang, Juan ; Zhou, Jiao ; Xu, Yan ; An, Jing ; Warshel, Arieh ; Huang, Ziwei

Journal of the American Chemical Society, 2023-12, Vol.145 (50), p.27248-27253 [Periódico revisado por pares]

United States: American Chemical Society

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10
Revisiting the protomotive vectorial motion of F₀-ATPase
Revisiting the protomotive vectorial motion of F₀-ATPase
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Revisiting the protomotive vectorial motion of F₀-ATPase

Bai, Chen ; Warshel, Arieh

Proceedings of the National Academy of Sciences - PNAS, 2019-09, Vol.116 (39), p.19484-19489 [Periódico revisado por pares]

Washington: National Academy of Sciences

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