Adsorptive separation of carbon dioxide: From conventional porous materials to metal–organic frameworks DD Zhou, XW Zhang, ZW Mo, YZ Xu, XY Tian, Y Li, XM Chen, JP Zhang EnergyChem 1 (3), 100016, 2019 | 144 | 2019 |
Selective extraction of methane from C1/C2/C3 on moisture-resistant MIL-142A with interpenetrated networks Y Yuan, H Wu, Y Xu, D Lv, S Tu, Y Wu, Z Li, Q Xia Chemical Engineering Journal 395, 125057, 2020 | 62 | 2020 |
Moisture stability of ethane‐selective Ni (II), Fe (III), Zr (IV)‐based metal–organic frameworks D Lv, J Chen, Y Chen, Z Liu, Y Xu, C Duan, H Wu, Y Wu, J Xiao, H Xi, Z Li, ... AIChE Journal 65 (8), e16616, 2019 | 40 | 2019 |
A local hydrophobic environment in a metal–organic framework for boosting photocatalytic CO 2 reduction in the presence of water NY Huang, XW Zhang, YZ Xu, PQ Liao, XM Chen Chemical Communications 55 (98), 14781-14784, 2019 | 40 | 2019 |
Unlocking the drug potential of the bryostatin family: recent advances in product synthesis and biomedical applications R Wu, H Chen, N Chang, Y Xu, J Jiao, H Zhang Chemistry–A European Journal 26 (6), 1166-1195, 2020 | 24 | 2020 |
Hydrogen evolution prediction for alternating conjugated copolymers enabled by machine learning with multidimension fragmentation descriptors Y Xu, CW Ju, B Li, QS Ma, Z Chen, L Zhang, J Chen ACS Applied Materials & Interfaces 13 (29), 34033-34042, 2021 | 21 | 2021 |
Machine learning in energy chemistry: introduction, challenges and perspectives Y Xu, J Ge, CW Ju Energy Advances 2 (7), 896-921, 2023 | 13 | 2023 |
Evolution of organic phosphor through precision regulation of nonradiative decay CW Ju, XC Wang, B Li, Q Ma, Y Shi, J Zhang, Y Xu, Q Peng, D Zhao Proceedings of the National Academy of Sciences 120 (46), e2310883120, 2023 | 9 | 2023 |
Aptasensor-encapsulating semi-permeable proteinosomes for direct target detection in non-treated biofluids J Kim, H Yoo, S Woo, SS Oh Biosensors and Bioelectronics 251, 116062, 2024 | 4 | 2024 |
On the design space between molecular mechanics and machine learning force fields Y Wang, K Takaba, MS Chen, M Wieder, Y Xu, T Zhu, JZH Zhang, ... arXiv preprint arXiv:2409.01931, 2024 | 3 | 2024 |
Beyond finite data: Towards data-free out-of-distribution generalization via extrapola Y Li, S Ren, W Deng, Y Xu, Y Gao, E Ngai, H Wang arXiv e-prints, arXiv: 2403.05523, 2024 | 2 | 2024 |
Machine Learning-Assisted High-Throughput Semi-empirical Search of OFET Molecular Materials Z Chen, J Li, Y Xu arXiv preprint arXiv:2107.02613, 2021 | 1 | 2021 |
Discovery of New Synthetic Routes of Amino Acids in Prebiotic Chemistry XT Li, S Mi, Y Xu, BW Li, T Zhu, JZH Zhang JACS Au 4 (12), 4757-4768, 2024 | | 2024 |
ChemXTree: A Feature-Enhanced Graph Neural Network-Neural Decision Tree Framework for ADMET Prediction Y Xu, X Liu, W Xia, J Ge, CW Ju, H Zhang, JZH Zhang Journal of Chemical Information and Modeling 64 (22), 8440-8452, 2024 | | 2024 |
EnviroDetaNet: Pretrained E (3)-equivariant Message-Passing Neural Networks with Multi-Level Molecular Representations for Organic Molecule Spectra Prediction Y Xu, D Bian, CW Ju, F Zhao, P Xie, Y Wang, W Hu, Z Sun, J Zhang, T Zhu | | 2024 |
Exploring Optimized Organic Fluorophore Search Through Simple Experimental Data-Driven VAE C Ju, Y Xu, Y Luo, B Li, W Jiang, J Zhang, H Bai, Z Wang, J Ge, R Lin, ... | | 2024 |