Chen CY - Search Results

1

Scalable crystal structure relaxation using an iteration-free deep generative model with uncertainty quantification.

Yang Z, Zhao YM, Wang X, Liu X, Zhang X, Li Y, Lv Q, Chen CY, Shen L. Yang Z, et al. Among authors: chen cy. Nat Commun. 2024 Sep 17;15(1):8148. doi: 10.1038/s41467-024-52378-3. Nat Commun. 2024. PMID: 39289379 Free PMC article.

2

Artificial Intelligence Approach to Find Lead Compounds for Treating Tumors.

Chen JQ, Chen HY, Dai WJ, Lv QJ, Chen CY. Chen JQ, et al. Among authors: chen hy, chen cy. J Phys Chem Lett. 2019 Aug 1;10(15):4382-4400. doi: 10.1021/acs.jpclett.9b01426. Epub 2019 Jul 22. J Phys Chem Lett. 2019. PMID: 31304749

3

Artificial Intelligence Approach To Investigate the Longevity Drug.

Li JY, Chen HY, Dai WJ, Lv QJ, Chen CY. Li JY, et al. Among authors: chen hy, chen cy. J Phys Chem Lett. 2019 Sep 5;10(17):4947-4961. doi: 10.1021/acs.jpclett.9b02220. Epub 2019 Aug 14. J Phys Chem Lett. 2019. PMID: 31411476

4

ML-DTI: Mutual Learning Mechanism for Interpretable Drug-Target Interaction Prediction.

Yang Z, Zhong W, Zhao L, Chen CY. Yang Z, et al. Among authors: chen cy. J Phys Chem Lett. 2021 May 6;12(17):4247-4261. doi: 10.1021/acs.jpclett.1c00867. Epub 2021 Apr 27. J Phys Chem Lett. 2021. PMID: 33904745

5

Multitask deep learning with dynamic task balancing for quantum mechanical properties prediction.

Yang Z, Zhong W, Lv Q, Chen CY. Yang Z, et al. Among authors: chen cy. Phys Chem Chem Phys. 2022 Mar 2;24(9):5383-5393. doi: 10.1039/d1cp05172e. Phys Chem Chem Phys. 2022. PMID: 35169821

6

TCMBank-the largest TCM database provides deep learning-based Chinese-Western medicine exclusion prediction.

Lv Q, Chen G, He H, Yang Z, Zhao L, Zhang K, Chen CY. Lv Q, et al. Among authors: chen cy, chen g. Signal Transduct Target Ther. 2023 Mar 31;8(1):127. doi: 10.1038/s41392-023-01339-1. Signal Transduct Target Ther. 2023. PMID: 36997527 Free PMC article. No abstract available.

7

Retrosynthesis prediction using an end-to-end graph generative architecture for molecular graph editing.

Zhong W, Yang Z, Chen CY. Zhong W, et al. Among authors: chen cy. Nat Commun. 2023 May 25;14(1):3009. doi: 10.1038/s41467-023-38851-5. Nat Commun. 2023. PMID: 37230985 Free PMC article.

8

3D graph neural network with few-shot learning for predicting drug-drug interactions in scaffold-based cold start scenario.

Lv Q, Zhou J, Yang Z, He H, Chen CY. Lv Q, et al. Among authors: chen cy. Neural Netw. 2023 Aug;165:94-105. doi: 10.1016/j.neunet.2023.05.039. Epub 2023 May 25. Neural Netw. 2023. PMID: 37276813

9

TCMBank: bridges between the largest herbal medicines, chemical ingredients, target proteins, and associated diseases with intelligence text mining.

Lv Q, Chen G, He H, Yang Z, Zhao L, Chen HY, Chen CY. Lv Q, et al. Among authors: chen hy, chen cy, chen g. Chem Sci. 2023 Aug 8;14(39):10684-10701. doi: 10.1039/d3sc02139d. eCollection 2023 Oct 11. Chem Sci. 2023. PMID: 37829020 Free PMC article.

10

Equivariant Flexible Modeling of the Protein-Ligand Binding Pose with Geometric Deep Learning.

Dong T, Yang Z, Zhou J, Chen CY. Dong T, et al. Among authors: chen cy. J Chem Theory Comput. 2023 Nov 28;19(22):8446-8459. doi: 10.1021/acs.jctc.3c00273. Epub 2023 Nov 8. J Chem Theory Comput. 2023. PMID: 37938978

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