Yu J - Search Results

1

From theory to experiment: transformer-based generation enables rapid discovery of novel reactions.

Wang X, Yao C, Zhang Y, Yu J, Qiao H, Zhang C, Wu Y, Bai R, Duan H. Wang X, et al. Among authors: yu j. J Cheminform. 2022 Sep 2;14(1):60. doi: 10.1186/s13321-022-00638-z. J Cheminform. 2022. PMID: 36056425 Free PMC article.

2

Virtual data augmentation method for reaction prediction.

Wu X, Zhang Y, Yu J, Zhang C, Qiao H, Wu Y, Wang X, Wu Z, Duan H. Wu X, et al. Among authors: yu j. Sci Rep. 2022 Oct 12;12(1):17098. doi: 10.1038/s41598-022-21524-6. Sci Rep. 2022. PMID: 36224331 Free PMC article.

3

VGSC-DB: an online database of voltage-gated sodium channels.

Wang G, Yu J, Du H, Shen C, Zhang X, Liu Y, Zhang Y, Cao D, Pan P, Hou T. Wang G, et al. Among authors: yu j. J Cheminform. 2022 Nov 1;14(1):75. doi: 10.1186/s13321-022-00655-y. J Cheminform. 2022. PMID: 36320030 Free PMC article.

4

Organic Compound Synthetic Accessibility Prediction Based on the Graph Attention Mechanism.

Yu J, Wang J, Zhao H, Gao J, Kang Y, Cao D, Wang Z, Hou T. Yu J, et al. J Chem Inf Model. 2022 Jun 27;62(12):2973-2986. doi: 10.1021/acs.jcim.2c00038. Epub 2022 Jun 8. J Chem Inf Model. 2022. PMID: 35675668

5

Kinome-wide polypharmacology profiling of small molecules by multi-task graph isomorphism network approach.

Bao L, Wang Z, Wu Z, Luo H, Yu J, Kang Y, Cao D, Hou T. Bao L, et al. Among authors: yu j. Acta Pharm Sin B. 2023 Jan;13(1):54-67. doi: 10.1016/j.apsb.2022.05.004. Epub 2022 May 12. Acta Pharm Sin B. 2023. PMID: 36815050 Free PMC article.

6

Can molecular dynamics simulations improve predictions of protein-ligand binding affinity with machine learning?

Gu S, Shen C, Yu J, Zhao H, Liu H, Liu L, Sheng R, Xu L, Wang Z, Hou T, Kang Y. Gu S, et al. Among authors: yu j. Brief Bioinform. 2023 Mar 19;24(2):bbad008. doi: 10.1093/bib/bbad008. Brief Bioinform. 2023. PMID: 36681903

7

Surrounding-aware representation prediction in Birds-Eye-View using transformers.

Yu J, Zheng W, Chen Y, Zhang Y, Huang R. Yu J, et al. Front Neurosci. 2023 Jul 4;17:1219363. doi: 10.3389/fnins.2023.1219363. eCollection 2023. Front Neurosci. 2023. PMID: 37469840 Free PMC article.

8

Structural view on the role of the TRD loop in regulating DNMT3A activity: a molecular dynamics study.

Zhao H, Yu J, Weng G, Yu J, Wang E, Gao J, Liu H, Hou T, Wang Z, Kang Y. Zhao H, et al. Among authors: yu j. Phys Chem Chem Phys. 2022 Jul 6;24(26):15791-15801. doi: 10.1039/d2cp02031a. Phys Chem Chem Phys. 2022. PMID: 35758413

9

Outcomes of Allogeneic Hematopoietic Stem Cell Transplantation in Patients Aged 70 Years and Older: A Systematic Review and Meta-analysis.

Shahzad M, Iqbal Q, Amin MK, Kasaiean A, Oskouie IM, Warraich SZ, Yu J, Anwar I, Jaglal M, Mushtaq MU. Shahzad M, et al. Among authors: yu j. Transplant Cell Ther. 2025 Jan 2:S2666-6367(24)00842-X. doi: 10.1016/j.jtct.2024.12.022. Online ahead of print. Transplant Cell Ther. 2025. PMID: 39755255 Review.

10

Hydrolysis and transport characteristics of starch inclusion complexes with long-chain alkyl gallates: Controlled two-step release of gallic acid and retardation of starch digestion.

Chen X, Wang X, Wang Q, Cai D, Yu J, Zhou D, Liu X, Yin F. Chen X, et al. Among authors: yu j. Int J Biol Macromol. 2025 Jan 2:139337. doi: 10.1016/j.ijbiomac.2024.139337. Online ahead of print. Int J Biol Macromol. 2025. PMID: 39755318

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