Sheng-Yong Yang - researchr alias

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Viewing Publication 1 - 16 from 16

2024

PocketFlow is a data-and-knowledge-driven structure-based molecular generative modelYuanyuan Jiang, Guo Zhang, Jing You, Hailin Zhang, Rui Yao, Huan-Zhang Xie, Liyun Zhang, Ziyi Xia, Mengzhe Dai, Yunjie Wu, Linli Li, Sheng-Yong Yang. natmi, 6(3):326-337, 2024. [doi]

2022

Discovery of Small Molecule Agonist of Gonadotropin-Releasing Hormone Receptor (GnRH1R)Xin Yang, Guifeng Lin, Anjie Xia, Jingming Liu, Shiyu Zhang, Pei Zhou, Yiwei Wang, Jiahao Zhang, Yangli Zhou, Pei Chen, Yifei Wang, Tao Zheng, Linli Li, Sheng-Yong Yang. jcisd, 62(20):5009-5022, 2022. [doi]

2017

Individualized network-based drug repositioning infrastructure for precision oncology in the panomics eraFeixiong Cheng, Huixiao Hong, Sheng-Yong Yang, Yuquan Wei. bib, 18(4):682-697, 2017. [doi]

Discovery of New SIRT2 Inhibitors by Utilizing a Consensus Docking/Scoring Strategy and Structure-Activity Relationship AnalysisShenzhen Huang, Chunli Song, Xiang Wang, Guo Zhang, Yanlin Wang, Xiaojuan Jiang, Qizheng Sun, Luyi Huang, Rong Xiang, Yiguo Hu, Linli Li, Sheng-Yong Yang. jcisd, 57(4):669-679, 2017. [doi]

IFPTarget: A Customized Virtual Target Identification Method Based on Protein-Ligand Interaction Fingerprinting AnalysesGuo-Bo Li, Zhu-jun Yu, Sha Liu, Lu-Yi Huang, Ling-Ling Yang, Christopher T. Lohans, Sheng-Yong Yang. jcisd, 57(7):1640-1651, July 2017. [doi]

HEROD: a human ethnic and regional specific omics databaseXian Zeng, Lin Tao, Peng Zhang, Chu Qin, Shangying Chen, Weidong He, Ying Tan, Hong-Xia Liu, Sheng-Yong Yang, Zhe Chen, Yu Yang Jiang, Yu Zong Chen. bioinformatics, 33(20):3276-3282, 2017. [doi]

2015

CFam: a chemical families database based on iterative selection of functional seeds and seed-directed compound clusteringCheng Zhang, Lin Tao, Chu Qin, Peng Zhang, Shangying Chen, Xian Zeng, Feng Xu, Zhe Chen, Sheng-Yong Yang, Yu Zong Chen. nar, 43(Database-Issue):558-565, 2015. [doi]

2014

2013

ID-Score: A New Empirical Scoring Function Based on a Comprehensive Set of Descriptors Related to Protein-Ligand InteractionsGuo-Bo Li, Ling-Ling Yang, Wen Jing Wang, Lin-Li Li, Sheng-Yong Yang. jcisd, 53(3):592-600, 2013. [doi]

2011

RASA: A Rapid Retrosynthesis-Based Scoring Method for the Assessment of Synthetic Accessibility of Drug-like MoleculesQi Huang, Lin-Li Li, Sheng-Yong Yang. jcisd, 51(10):2768-2777, 2011. [doi]

Effect of training data size and noise level on support vector machines virtual screening of genotoxic compounds from large compound librariesPankaj Kumar, Xiao Hua Ma, Xianghui Liu, Jia Jia, Han Bucong, Ying Xue, Ze-Rong Li, Sheng-Yong Yang, Yu-Quan Wei, Yu Zong Chen. jcamd, 25(5):455-467, 2011. [doi]

Discovery of Novel Pim-1 Kinase Inhibitors by a Hierarchical Multistage Virtual Screening Approach Based on SVM Model, Pharmacophore, and Molecular DockingJi-Xia Ren, Lin-Li Li, Ren-Lin Zheng, Huan-Zhang Xie, Zhi-Xing Cao, Shan Feng, You-Li Pan, Xin Chen, Yu-Quan Wei, Sheng-Yong Yang. jcisd, 51(6):1364-1375, 2011. [doi]

A prediction model of substrates and non-substrates of breast cancer resistance protein (BCRP) developed by GA-CG-SVM methodLei Zhong, Chang-Ying Ma, Hui Zhang 0007, Li-Jun Yang, Hua-Lin Wan, Qing-Qing Xie, Lin-Li Li, Sheng-Yong Yang. cbm, 41(11):1006-1013, 2011. [doi]

2009

An integrated scheme for feature selection and parameter setting in the support vector machine modeling and its application to the prediction of pharmacokinetic properties of drugsSheng-Yong Yang, Qi Huang, Lin-Li Li, Chang-Ying Ma, Hui Zhang, Ru-bai, Qi-Zhi Teng, Ming-Li Xiang, Yu-Quan Wei. artmed, 46(2):155-163, 2009. [doi]

2007

Free energy profiles for monomer capture in Grubbs- and SHOP-type olefin polymerization catalysts: A constraint ::::ab initio:::: molecular dynamics studySheng-Yong Yang, Ming-Li Xiang, Li-Juan Chen, Guo-Bin Xie, Bing Shi, Yu-Quan Wei, Tom Ziegler. jcc, 28(2):513-518, 2007. [doi]

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