Hou T - Search Results

1

ChemFH: an integrated tool for screening frequent false positives in chemical biology and drug discovery.

Shi S, Fu L, Yi J, Yang Z, Zhang X, Deng Y, Wang W, Wu C, Zhao W, Hou T, Zeng X, Lyu A, Cao D. Shi S, et al. Among authors: hou t. Nucleic Acids Res. 2024 Jul 5;52(W1):W439-W449. doi: 10.1093/nar/gkae424. Nucleic Acids Res. 2024. PMID: 38783035 Free PMC article.

2

Structural Analysis and Identification of Colloidal Aggregators in Drug Discovery.

Yang ZY, Yang ZJ, Dong J, Wang LL, Zhang LX, Ding JJ, Ding XQ, Lu AP, Hou TJ, Cao DS. Yang ZY, et al. J Chem Inf Model. 2019 Sep 23;59(9):3714-3726. doi: 10.1021/acs.jcim.9b00541. Epub 2019 Aug 27. J Chem Inf Model. 2019. PMID: 31430151

3

ADMET Evaluation in Drug Discovery. 19. Reliable Prediction of Human Cytochrome P450 Inhibition Using Artificial Intelligence Approaches.

Wu Z, Lei T, Shen C, Wang Z, Cao D, Hou T. Wu Z, et al. Among authors: hou t. J Chem Inf Model. 2019 Nov 25;59(11):4587-4601. doi: 10.1021/acs.jcim.9b00801. Epub 2019 Nov 5. J Chem Inf Model. 2019. PMID: 31644282

4

Systematic Modeling of log D_7.4 Based on Ensemble Machine Learning, Group Contribution, and Matched Molecular Pair Analysis.

Fu L, Liu L, Yang ZJ, Li P, Ding JJ, Yun YH, Lu AP, Hou TJ, Cao DS. Fu L, et al. J Chem Inf Model. 2020 Jan 27;60(1):63-76. doi: 10.1021/acs.jcim.9b00718. Epub 2020 Jan 10. J Chem Inf Model. 2020. PMID: 31869226

5

Combined strategies in structure-based virtual screening.

Wang Z, Sun H, Shen C, Hu X, Gao J, Li D, Cao D, Hou T. Wang Z, et al. Among authors: hou t. Phys Chem Chem Phys. 2020 Feb 14;22(6):3149-3159. doi: 10.1039/c9cp06303j. Epub 2020 Jan 29. Phys Chem Chem Phys. 2020. PMID: 31995074 Review.

6

Binding affinity and dissociation pathway predictions for a series of USP7 inhibitors with pyrimidinone scaffold by multiple computational methods.

Wang Z, Wang X, Kang Y, Zhong H, Shen C, Yao X, Cao D, Hou T. Wang Z, et al. Among authors: hou t. Phys Chem Chem Phys. 2020 Mar 14;22(10):5487-5499. doi: 10.1039/d0cp00370k. Epub 2020 Feb 26. Phys Chem Chem Phys. 2020. PMID: 32101223

7

Structural Analysis and Identification of False Positive Hits in Luciferase-Based Assays.

Yang ZY, Dong J, Yang ZJ, Lu AP, Hou TJ, Cao DS. Yang ZY, et al. J Chem Inf Model. 2020 Apr 27;60(4):2031-2043. doi: 10.1021/acs.jcim.9b01188. Epub 2020 Mar 30. J Chem Inf Model. 2020. PMID: 32202787

8

Comprehensive Evaluation of Fourteen Docking Programs on Protein-Peptide Complexes.

Weng G, Gao J, Wang Z, Wang E, Hu X, Yao X, Cao D, Hou T. Weng G, et al. Among authors: hou t. J Chem Theory Comput. 2020 Jun 9;16(6):3959-3969. doi: 10.1021/acs.jctc.9b01208. Epub 2020 May 6. J Chem Theory Comput. 2020. PMID: 32324992

9

Beware of the generic machine learning-based scoring functions in structure-based virtual screening.

Shen C, Hu Y, Wang Z, Zhang X, Pang J, Wang G, Zhong H, Xu L, Cao D, Hou T. Shen C, et al. Among authors: hou t. Brief Bioinform. 2021 May 20;22(3):bbaa070. doi: 10.1093/bib/bbaa070. Brief Bioinform. 2021. PMID: 32484221

10

Fast and accurate prediction of partial charges using Atom-Path-Descriptor-based machine learning.

Wang J, Cao D, Tang C, Chen X, Sun H, Hou T. Wang J, et al. Among authors: hou t. Bioinformatics. 2020 Sep 15;36(18):4721-4728. doi: 10.1093/bioinformatics/btaa566. Bioinformatics. 2020. PMID: 32525553

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