Hao Dong

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 24

Top Topics

Top Venues

Journal of chemical theory and computation

The journal of physical chemistry. B

Journal of the American Chemical Society

ACS applied materials & interfaces

This page only lists publications with an associated author ORCID identifier.

Publications

Yuqin Yang, Xiaoyu Wang, Xialian Wu, Shuyi Guo, Haokun Yang, Junxia Lu, Hao Dong
Computation-Driven Rational Design of Self-Assembled Short Peptides for Catalytic Hydrogen Production. Journal of the American Chemical Society (2024)
Jiasheng Guo, Chenning Yu, Kenan Li, Yijian Zhang, Guoqiang Wang, Shu-Hua Li, Hao Dong
Retrosynthesis Zero: Self-Improving Global Synthesis Planning Using Reinforcement Learning. Journal of chemical theory and computation 20 (11) (2024)
Jiasheng Guo, Chenning Yu, Kenan Li, Yijian Zhang, Guoqiang Wang, Shu-Hua Li, Hao Dong
Retrosynthesis Zero: Self-Improving Global Synthesis Planning Using Reinforcement Learning. Journal of chemical theory and computation (2024)
Yuqin Yang, Xiaoyu Wang, Xialian Wu, Shuyi Guo, Haokun Yang, Junxia Lu, Hao Dong
Computation-Driven Rational Design of Self-Assembled Short Peptides for Catalytic Hydrogen Production. Journal of the American Chemical Society 146 (19) (2024)
Yang Ge, Xueping Wang, Qiang Zhu, Yuqin Yang, Hao Dong, Jing Ma
Machine Learning-Guided Adaptive Parametrization for Coupling Terms in a Mixed United-Atom/Coarse-Grained Model for Diphenylalanine Self-Assembly in Aqueous Ionic Liquids. Journal of chemical theory and computation (2023)
Youyuan Zhu, Ruizhe Shen, Hao Dong, Wei Wang
Spatial heterogeneity and infection patterns on epidemic transmission disclosed by a combined contact-dependent dynamics and compartmental model. PloS one 18 (6) (2023)
Jun Huo, Jianghao Chen, Pei Liu, Ben-Kun Hong, Jian Zhang, Hao Dong, Shu-Hua Li
Microscopic Mechanism of Proton Transfer in Pure Water under Ambient Conditions. Journal of chemical theory and computation (2023)
Hongwei Chen, Changchang Lv, Lin Guo, Ming Ma, Xiangfeng Li, Zhengyi Lan, Jun Huo, Hao Dong, Xiangdong Zhu, Qiang Zhu, Yuming Gu, Ziteng Liu, Jianjun Liu, Hang-Rong Chen, Xuefeng Guo, Jing Ma
Surface Stability and Morphology of Calcium Phosphate Tuned by pH Values and Lactic Acid Additives: Theoretical and Experimental Study. ACS applied materials & interfaces 14 (4) (2022)
Yiqiao Wang, Luyuan Zhao, Xuejie Zhou, Jian Zhang, Jun Jiang, Hao Dong
Global Fold Switching of the RafH Protein: Diverse Structures with a Conserved Pathway. The journal of physical chemistry. B 126 (16) (2022)
Youyuan Zhu, Yijun Bai, Hao Dong, Wei Wang
A bottom-up design strategy for controllable self-assembly based on the isotropic double-well potential. Physical chemistry chemical physics : PCCP 24 (16) (2022)
Yuqin Yang, Hao Dong, Huan-Xiang Zhou
Effects of Cholesterol on the Partitioning of a Drug Molecule in Lipid Bilayers. The journal of physical chemistry. B 125 (20) (2021)
Le Li, Adnan Ozden, Shuyi Guo, F Pelayo García de Arquer, Chuanhao Wang, Mingzhe Zhang, Jin Zhang, Haoyang Jiang, Wei Wang, Hao Dong, David Sinton, Edward H Sargent, Miao Zhong
Stable, active CO2 reduction to formate via redox-modulated stabilization of active sites. Nature communications 12 (1) (2021)
Sanling Liu, Yue Zhao, Hao Dong, Liang Xiao, Yong Zhang, Yuqin Yang, Seow Theng Ong, K George Chandy, Longhua Zhang, Changlin Tian
Structures of wild-type and H451N mutant human lymphocyte potassium channel KV1.3. Cell discovery 7 (1) (2021)
Yu Chen, Yuqin Yang, Asuka A Orr, Pandeeswar Makam, Boris Redko, Elvira Haimov, Yannan Wang, Linda J W Shimon, Sigal Rencus-Lazar, Meiting Ju, Phanourios Tamamis, Hao Dong, Ehud Gazit
Self-Assembled Peptide Nano-Superstructure towards Enzyme Mimicking Hydrolysis. Angewandte Chemie (International ed. in English) 60 (31) (2021)
Dongbo Zhao, Xiaoling Shen, Zheng Cheng, Wei Li, Hao Dong, Shu-Hua Li
Accurate and Efficient Prediction of NMR Parameters of Condensed-Phase Systems with the Generalized Energy-Based Fragmentation Method. Journal of chemical theory and computation 16 (5) (2020)
Yigao Yuan, Qiang Zhu, Ruiheng Song, Jing Ma, Hao Dong
A Two-Ended Data-Driven Accelerated Sampling Method for Exploring the Transition Pathways between Two Known States of Protein. Journal of chemical theory and computation 16 (7) (2020)
Dongfang Tang, Yuqin Yang, Zhen Xiao, Jiahui Xu, Qiuchu Yang, Han Dai, Songping Liang, Cheng Tang, Hao Dong, Zhonghua Liu
Scorpion toxin inhibits the voltage-gated proton channel using a Zn2+ -like long-range conformational coupling mechanism. British journal of pharmacology 177 (10) (2020)
Wei Li, Hao Dong, Jing Ma, Shu-Hua Li
Structures and Spectroscopic Properties of Large Molecules and Condensed-Phase Systems Predicted by Generalized Energy-Based Fragmentation Approach. Accounts of chemical research 54 (1) (2020)
Ying Chen, Dongbo Zhao, Jiaju Fu, Xiaodan Gou, De-Chen Jiang, Hao Dong, Jun-Jie Zhu
In Situ Imaging Facet-Induced Spatial Heterogeneity of Electrocatalytic Reaction Activity at the Subparticle Level via Electrochemiluminescence Microscopy. Analytical chemistry 91 (10) (2019)
Weijie Song, Gengjie Wang, Dongbo Zhao, Yuewei Zhou, Yuying Ding, Changbin Tan, Shaochun Tang, Hao Dong, Xiangkang Meng
Achieving Rich Mixed-Valence Polysulfide/Carbon Nanotube Films toward Ultrahigh Volume Energy Density and Largely Deformable Pseudocapacitors. ACS applied materials & interfaces 11 (28) (2019)
Ruiheng Song, Xialian Wu, Bin Xue, Yuqin Yang, Wenmao Huang, Guixiang Zeng, Jian Wang, Wenfei Li, Yi Cao, Wei Wang, Jun-Xia Lu, Hao Dong
Principles Governing Catalytic Activity of Self-Assembled Short Peptides. Journal of the American Chemical Society 141 (1) (2018)
Dongbo Zhao, Ruiheng Song, Wei Li, Jing Ma, Hao Dong, Shu-Hua Li
Accurate Prediction of NMR Chemical Shifts in Macromolecular and Condensed-Phase Systems with the Generalized Energy-Based Fragmentation Method. Journal of chemical theory and computation 13 (11) (2017)
Dongbo Zhao, Ling Yang, Yigao Yuan, Hanchen Wang, Hao Dong, Shu-Hua Li
Molecular Mechanism of Self-Assembly of Aromatic Oligoamides into Interlocked Double-Helix Foldamers. The journal of physical chemistry. B 121 (43) (2017)
Qiang Zhu, Yilin Lu, Xibing He, Tao Liu, Hongwei Chen, Fang Wang, Dong Zheng, Hao Dong, Jing Ma
Entropy and Polarity Control the Partition and Transportation of Drug-like Molecules in Biological Membrane. Scientific reports 7 (1) (2017)