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Entropic Path Sampling: Computational Protocol to Evaluate Entropic Profile along a Reaction Path
Entropic Path Sampling: Computational Protocol to Evaluate Entropic Profile along a Reaction Path
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Entropic Path Sampling: Computational Protocol to Evaluate Entropic Profile along a Reaction Path

Qin, Zhi-Xin ; Tremblay, Matthew ; Hong, Xin ; Yang, Zhongyue J

The journal of physical chemistry letters, 2021-11, Vol.12 (43), p.10713-10719 [Periódico revisado por pares]

American Chemical Society

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Convergence in determining enzyme functional descriptors across Kemp eliminase variants
Convergence in determining enzyme functional descriptors across Kemp eliminase variants
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Convergence in determining enzyme functional descriptors across Kemp eliminase variants

Jiang, Yaoyukun ; Stull, Sebastian L ; Shao, Qianzhen ; Yang, Zhongyue J

Electronic Structure, 2022-12, Vol.4 (4), p.44007 [Periódico revisado por pares]

England: IOP Publishing

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3
Dioxygen Activation by Iron Complexes: The Catalytic Role of Intersystem Crossing Dynamics for a Heme-Related Model
Dioxygen Activation by Iron Complexes: The Catalytic Role of Intersystem Crossing Dynamics for a Heme-Related Model
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Dioxygen Activation by Iron Complexes: The Catalytic Role of Intersystem Crossing Dynamics for a Heme-Related Model

Du, Likai ; Liu, Fang ; Li, Yanwei ; Yang, Zhongyue ; Zhang, Qingzhu ; Zhu, Chaoyuan ; Gao, Jun

Journal of physical chemistry. C, 2018-02, Vol.122 (5), p.2821-2831 [Periódico revisado por pares]

American Chemical Society

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4
Quantum Mechanical Description of Electrostatics Provides a Unified Picture of Catalytic Action Across Methyltransferases
Quantum Mechanical Description of Electrostatics Provides a Unified Picture of Catalytic Action Across Methyltransferases
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Quantum Mechanical Description of Electrostatics Provides a Unified Picture of Catalytic Action Across Methyltransferases

Yang, Zhongyue ; Liu, Fang ; Steeves, Adam H ; Kulik, Heather J

The journal of physical chemistry letters, 2019-07, Vol.10 (13), p.3779-3787 [Periódico revisado por pares]

United States: American Chemical Society

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5
Processing heterogeneously structured oxide-dispersion-strengthened Fe-10Cr-6.1Al-0.3Zr-0.1Y alloy for simultaneously enhanced strength and ductility
Processing heterogeneously structured oxide-dispersion-strengthened Fe-10Cr-6.1Al-0.3Zr-0.1Y alloy for simultaneously enhanced strength and ductility
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Processing heterogeneously structured oxide-dispersion-strengthened Fe-10Cr-6.1Al-0.3Zr-0.1Y alloy for simultaneously enhanced strength and ductility

Cao, Tinghui ; Wu, Yake ; Huang, Pengpeng ; Wang, Jiaqing ; Yang, Zhongyue ; Jiang, Feng ; Ma, Evan

Journal of materials science & technology, 2025-02, Vol.207, p.95-104 [Periódico revisado por pares]

Elsevier Ltd

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6
A theoretical study of phosphorescent Cu(I) complexes with 2-(2'quinolyl)imidazole and POP mixed ligands
A theoretical study of phosphorescent Cu(I) complexes with 2-(2'quinolyl)imidazole and POP mixed ligands
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A theoretical study of phosphorescent Cu(I) complexes with 2-(2'quinolyl)imidazole and POP mixed ligands

He, Tengfei ; Ren, Aimin ; Chen, Shuming ; Yang, Zhongyue ; Yu, Peiyuan ; Chen, Yuannan ; Ding, Xiaoli ; Shen, Lu ; Zhang, Hongxing ; Zou, Luyi

Organic electronics, 2017-06, Vol.45, p.9-19 [Periódico revisado por pares]

Elsevier B.V

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7
Electron Highways into Nanochannels of Covalent Organic Frameworks for High Electrical Conductivity and Energy Storage
Electron Highways into Nanochannels of Covalent Organic Frameworks for High Electrical Conductivity and Energy Storage
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Electron Highways into Nanochannels of Covalent Organic Frameworks for High Electrical Conductivity and Energy Storage

Wu, Yang ; Yan, Dongwan ; Zhang, Zhongyue ; Matsushita, Michio M ; Awaga, Kunio

ACS applied materials & interfaces, 2019-02, Vol.11 (8), p.7661-7665 [Periódico revisado por pares]

United States: American Chemical Society

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8
High-temperature dynamic corrosion mechanisms of austenitic stainless and carbon steels in nitrates for concentrating solar power
High-temperature dynamic corrosion mechanisms of austenitic stainless and carbon steels in nitrates for concentrating solar power
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High-temperature dynamic corrosion mechanisms of austenitic stainless and carbon steels in nitrates for concentrating solar power

Yang, Pu ; Deng, Zhongyue ; Chen, Bingqing ; Wang, Yueshe

Solar energy materials and solar cells, 2024-03, Vol.266, p.112690, Article 112690 [Periódico revisado por pares]

Elsevier B.V

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9
Chiral Transport in Nanochannel Based Artificial Drug Transporters
Chiral Transport in Nanochannel Based Artificial Drug Transporters
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Chiral Transport in Nanochannel Based Artificial Drug Transporters

Yang, Lei ; Sun, Zhongyue ; Zhang, Siyun ; Sun, Yue ; Li, Haibing

Small (Weinheim an der Bergstrasse, Germany), 2023-02, Vol.19 (6), p.e2205274-n/a [Periódico revisado por pares]

Germany: Wiley Subscription Services, Inc

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10
Research Progress of Natural Products and Their Derivatives in Marine Antifouling
Research Progress of Natural Products and Their Derivatives in Marine Antifouling
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Research Progress of Natural Products and Their Derivatives in Marine Antifouling

Zhao, Wenwen ; Wu, Zhiqiang ; Liu, Yanming ; Dai, Pan ; Hai, Guojuan ; Liu, Feng ; Shang, Yu ; Cao, Zhongyue ; Yang, Wufang

Materials, 2023-09, Vol.16 (18), p.6190 [Periódico revisado por pares]

Basel: MDPI AG

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