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Quantum phase synchronization via exciton-vibrational energy dissipation sustains long-lived coherence in photosynthetic antennas
期刊论文
OAI收割
NATURE COMMUNICATIONS, 2024, 卷号: 15, 期号: 1, 页码: 10
作者:
Zhu, Ruidan
;
Li, Wenjun
;
Zhen, Zhanghe
;
Zou, Jiading
;
Liao, Guohong
  |  
收藏
  |  
浏览/下载:0/0
  |  
提交时间:2024/05/23
Quantum phase synchronization via exciton-vibrational energy dissipation sustains long-lived coherence in photosynthetic antennas
期刊论文
OAI收割
NATURE COMMUNICATIONS, 2024, 卷号: 15, 期号: 1, 页码: 10
作者:
Zhu, Ruidan
;
Li, Wenjun
;
Zhen, Zhanghe
;
Zou, Jiading
;
Liao, Guohong
  |  
收藏
  |  
浏览/下载:0/0
  |  
提交时间:2024/05/23
Impact of Halogen Bonds on Protein-Peptide Binding and Protein Structural Stability Revealed by Computational Approaches
期刊论文
OAI收割
JOURNAL OF MEDICINAL CHEMISTRY, 2024, 页码: 11
作者:
Li, Jintian
;
Zhou, Liping
;
Han, Zijian
;
Wu, Leyun
;
Zhang, Jianfang
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收藏
  |  
浏览/下载:0/0
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提交时间:2024/05/07
Quantum-classical rate coefficient datasets of vibrational energy transfer in carbon monoxide based on highly accurate potential energy surface
期刊论文
OAI收割
JOURNAL OF CHEMICAL PHYSICS, 2024, 卷号: 160, 期号: 8, 页码: 15
作者:
Hong QZ(洪启臻)
;
Storchi, Loriano
;
Coletti, Cecilia
;
Li, Jia
;
Sun QH(孙泉华)
  |  
收藏
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浏览/下载:9/0
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提交时间:2024/05/14
Entanglement Generation of Polar Molecules via Deep Reinforcement Learning
期刊论文
OAI收割
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2024
作者:
Zhang, Zuo-Yuan
;
Sun, Zhaoxi
;
Duan, Tao
;
Ding, Yi-Kai
;
Huang, Xinning
  |  
收藏
  |  
浏览/下载:63/0
  |  
提交时间:2024/03/26
Enzymatic Synthesis of Noncanonical α-Amino Acids Containing γ-Tertiary Alcohols
期刊论文
OAI收割
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2024, 页码: 9
作者:
Zhang, Rui
;
Zhang, Chenghua
;
Tan, Jiamu
;
He, Yifan
;
Zhuo, Dan
  |  
收藏
  |  
浏览/下载:24/0
  |  
提交时间:2024/02/27
Asymmetric Synthesis
Biocatalysis
Noncanonical Amino Acids
Quantum Chemical Calculations
Tertiary Alcohols
The emergence of machine learning force fields in drug design
期刊论文
OAI收割
MEDICINAL RESEARCH REVIEWS, 2024, 页码: 36
作者:
Chen, Mingan
;
Jiang, Xinyu
;
Zhang, Lehan
;
Chen, Xiaoxu
;
Wen, Yiming
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收藏
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浏览/下载:16/0
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提交时间:2024/02/19
computational chemistry
drug design
force field
machine learning
molecular modeling
Changes in groundwater dynamics and geochemical evolution induced by drainage reorganization: Evidence from 81Kr and 36Cl dating of geothermal water in the Weihe Basin of China
期刊论文
OAI收割
EARTH AND PLANETARY SCIENCE LETTERS, 2023, 卷号: 623, 页码: 9
作者:
Li, Jie
;
Pang, Zhonghe
;
Liu, Yulian
;
Hu, Shuiming
;
Jiang, Wei
  |  
收藏
  |  
浏览/下载:10/0
  |  
提交时间:2023/12/27
Kr-81 dating
Cl-36 dating
Geothermal water
Groundwater dynamics
Weihe basin
Improved Quantum-Classical Treatment of N
2
-N
2
Inelastic Collisions: Effect of the Potentials and Complete Rate Coefficient Data Sets
期刊论文
OAI收割
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2023, 卷号: 19, 期号: 23, 页码: 8557-8571
作者:
Hong, Qizhen
;
Storchi, Loriano
;
Sun, Quanhua
;
Bartolomei, Massimiliano
;
Pirani, Fernando
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收藏
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浏览/下载:4/0
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提交时间:2024/01/22
DeepStSNet: Reconstructing the quantum state-resolved thermochemical nonequilibrium flowfield using deep neural operator learning with scarce data
期刊论文
OAI收割
JOURNAL OF COMPUTATIONAL PHYSICS, 2023, 卷号: 491, 页码: 112344
作者:
Lv JQ(吕家琦)
;
Hong QZ(洪启臻)
;
Wang XY(王小永)
;
Mao, Zhiping
;
Sun QH(孙泉华)
  |  
收藏
  |  
浏览/下载:17/0
  |  
提交时间:2023/09/26
Hypersonic
Thermochemical nonequilibrium
State-to-state approach
Deep learning
Multiphysics
Data assimilation