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Kinetic and dynamic studies of the H-3(+) + CO -> H-2 + HCO+/HOC+ reaction on a high-level ab initio potential energy surface 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2019, 卷号: 151, 期号: 5, 页码: 10
Authors:  Zhu, Yongfa;  Tian, Li;  Song, Hongwei;  Yang, Minghui
Favorite  |  View/Download:10/0  |  Submit date:2019/10/14
Free-base porphyrins as CEST MRI contrast agents with highly upfield shifted labile protons 期刊论文
MAGNETIC RESONANCE IN MEDICINE, 2019, 卷号: 82, 期号: 2, 页码: 577-585
Authors:  Zhang, Xiaoxiao;  Yuan, Yaping;  Li, Sha;  Zeng, Qingbin;  Guo, Qianni;  Liu, Na;  Yang, Minghui;  Yang, Yunhuang;  Liu, Maili;  McMahon, Michael T.;  Zhou, Xin
Favorite  |  View/Download:16/0  |  Submit date:2019/10/14
CEST imaging  contrast agents  free-base porphyrin  upfield-shifted protons  molecular imaging  
The Observation of Ligand-Binding-Relevant Open States of Fatty Acid Binding Protein by Molecular Dynamics Simulations and a Markov State Model 期刊论文
INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES, 2019, 卷号: 20, 期号: 14, 页码: 13
Authors:  Guo, Yue;  Duan, Mojie;  Yang, Minghui
Favorite  |  View/Download:9/0  |  Submit date:2019/10/14
fatty acid binding protein  invisible intermediate states  transition time  binding mechanism  molecular dynamics simulation  
Structure-guided post-SELEX optimization of an ochratoxin A aptamer 期刊论文
NUCLEIC ACIDS RESEARCH, 2019, 卷号: 47, 期号: 11, 页码: 5963-5972
Authors:  Xu, Guohua;  Zhao, Jiajing;  Liu, Na;  Yang, Minghui;  Zhao, Qiang;  Li, Conggang;  Liu, Maili
Favorite  |  View/Download:10/0  |  Submit date:2019/10/14
Theoretical study of the F(2P) + NH3 -> HF + NH2 reaction on an accurate potential energy surface: dynamics and kinetics 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2019, 卷号: 21, 期号: 21, 页码: 11385-11394
Authors:  Tian, Li;  Zhu, Yongfa;  Song, Hongwei;  Yang, Minghui
Favorite  |  View/Download:9/0  |  Submit date:2019/10/14
Theoretical studies of strong-field photoionization of CH3I 期刊论文
CHEMICAL PHYSICS, 2019, 卷号: 516, 页码: 28-32
Authors:  Shi, Fan;  Zhang, Yingfeng;  Qi, Ji;  Song, Hongwei;  Yang, Minghui
Favorite  |  View/Download:31/0  |  Submit date:2018/12/17
understandingrotationalmodespecificityintheo3pchd3ohcd3reactionbysimplereactantalignmentpictures 期刊论文
chinesejournalofchemicalphysics, 2019, 卷号: 32, 期号: 1, 页码: 46
Authors:  Liu Rui;  Song Hongwei;  Yang Minghui
Favorite  |  View/Download:9/0  |  Submit date:2020/01/14
Dynamics and kinetics of the reaction OH + H2S -> H2O + SH on an accurate potential energy surface 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2018, 卷号: 20, 期号: 41, 页码: 26315-26324
Authors:  Ping, Leilei;  Zhu, Yongfa;  Li, Anyang;  Song, Hongwei;  Li, Yong;  Yang, Minghui
Favorite  |  View/Download:34/0  |  Submit date:2018/12/03
Tracking Ultrafast Bond Dissociation Dynamics at 0.1 angstrom Resolution by Femtosecond Extreme Ultraviolet Absorption Spectroscopy 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 2018, 卷号: 9, 期号: 19, 页码: 5742-5747
Authors:  Wei, Zhengrong;  Tian, Li;  Li, Jialin;  Lu, Yunpeng;  Yang, Minghui;  Loh, Zhi-Heng
Favorite  |  View/Download:21/0  |  Submit date:2018/12/03
New Method To Extract Final-State Information of Polyatomic Reactions Based on Normal Mode Analysis 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY A, 2018, 卷号: 122, 期号: 35, 页码: 6997-7005
Authors:  Ping, Leilei;  Tian, Li;  Song, Hongwei;  Yang, Minghui
Favorite  |  View/Download:30/0  |  Submit date:2018/11/05