Jing Ma
Affiliations: | Nanjing University, Nanjing Shi, Jiangsu Sheng, China |
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| Lei Y, Xie X, Ma H, et al. (2023) Vitality of Intralayer Vibration in hBN for Effective Long-Range Interlayer Hole Transfer across High Barriers in MoSe/hBN/WSe Heterostructures. The Journal of Physical Chemistry Letters. 11190-11199 |
| Zhang G, Zhu Q, Zheng H, et al. (2023) Prediction of free radical reactions toward organic pollutants with easily accessible molecular descriptors. Chemosphere. 346: 140660 |
| Gao L, Liang X, He L, et al. (2023) Base-mediated C-B bond activation of benzylic boronate for the rapid construction of β-silyl/boryl functionalized 1,1-diarylalkanes from aromatic alkenes. Chemical Science. 14: 11881-11889 |
| Ge Y, Wang X, Zhu Q, et al. (2023) 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 |
| Fu L, Wang R, Zhu Q, et al. (2023) Planar Chirality for Acid/Base Responsive Macrocyclic Pillararenes Induced by Amino Acid Derivatives: Molecular Dynamics Simulations and Machine Learning. Journal of Chemical Theory and Computation |
| Zhu Q, Ge Y, Li W, et al. (2023) Treating Polarization Effects in Charged and Polar Bio-Molecules Through Variable Electrostatic Parameters. Journal of Chemical Theory and Computation |
| Xiong Y, Li B, Gu Y, et al. (2022) Photocatalytic nitrogen fixation under an ambient atmosphere using a porous coordination polymer with bridging dinitrogen anions. Nature Chemistry |
| Du J, Liao K, Ma J, et al. (2022) Generalized Energy-Based Fragmentation Approach for the Electronic Emission Spectra of Large Systems. Journal of Chemical Theory and Computation |
| Zhu Q, Zhang S, Ma J, et al. (2022) Catalytic Mechanisms of Transfer Hydrogenation of Azobenzene with Ammonia Borane by Pincer Bismuth Complex: Crucial Role of C=N Functional Group on the Pincer Ligand. Chemistry, An Asian Journal |
| Jia Q, Ni Y, Liu Z, et al. (2022) Fast Prediction of Lipophilicity of Organofluorine Molecules: Deep Learning-Derived Polarity Characters and Experimental Tests. Journal of Chemical Information and Modeling |