Kaixian Chen

According to our database, Kaixian Chen authored at least 30 papers between 1998 and 2024.

Collaborative distances:

• Dijkstra number of four.
• Erdős number of four.

2024

Application of ensemble learning for predicting GABAA receptor agonists.

Fu Xiao, Xiaoyu Ding, Yan Shi, Dingyan Wang, Yitian Wang, Chen Cui, Tingfei Zhu, Kaixian Chen, Ping Xiang, Xiaomin Luo

Comput. Biol. Medicine, February, 2024

2023

Loops Mediate Agonist-Induced Activation of the Stimulator of Interferon Genes Protein.

Rui Li, Lin Chen, Xinheng He, Duanhua Cao, Zehong Zhang, Hualiang Jiang, Kaixian Chen, Xi Cheng

J. Chem. Inf. Model., December, 2023

LogD7.4 prediction enhanced by transferring knowledge from chromatographic retention time, microscopic pKa and logP.

Yitian Wang, Jiacheng Xiong, Fu Xiao, Wei Zhang, Kaiyang Cheng, Jingxin Rao, Buying Niu, Xiaochu Tong, Ning Qu, Runze Zhang, Dingyan Wang, Kaixian Chen, Xutong Li, Mingyue Zheng

J. Cheminformatics, December, 2023

OTTM: an automated classification tool for translational drug discovery from omics data.

Xiaobo Yang, Bei Zhang, Siqi Wang, Ye Lu, Kaixian Chen, Cheng Luo, Aihua Sun, Hao Zhang

Briefings Bioinform., September, 2023

2022

Multi-instance learning of graph neural networks for aqueous pKa prediction.

Jiacheng Xiong, Zhaojun Li, Guangchao Wang, Zunyun Fu, Feisheng Zhong, Tingyang Xu, Xiaomeng Liu, Ziming Huang, Xiaohong Liu, Kaixian Chen, Hualiang Jiang, Mingyue Zheng

Bioinform., 2022

2021

DrugSpaceX: a large screenable and synthetically tractable database extending drug space.

Tianbiao Yang, Zhaojun Li, Yingjia Chen, Dan Feng, Guangchao Wang, Zunyun Fu, Xiaoyu Ding, Xiaoqin Tan, Jihui Zhao, Xiaomin Luo, Kaixian Chen, Hualiang Jiang, Mingyue Zheng

Nucleic Acids Res., 2021

A hybrid framework for improving uncertainty quantification in deep learning-based QSAR regression modeling.

Dingyan Wang, Jie Yu, Lifan Chen, Xutong Li, Hualiang Jiang, Kaixian Chen, Mingyue Zheng, Xiaomin Luo

J. Cheminformatics, 2021

Drug repurposing against breast cancer by integrating drug-exposure expression profiles and drug-drug links based on graph neural network.

Chen Cui, Xiaoyu Ding, Dingyan Wang, Lifan Chen, Fu Xiao, Tingyang Xu, Mingyue Zheng, Xiaomin Luo, Hualiang Jiang, Kaixian Chen

Bioinform., 2021

2020

TransformerCPI: improving compound-protein interaction prediction by sequence-based deep learning with self-attention mechanism and label reversal experiments.

Lifan Chen, Xiaoqin Tan, Dingyan Wang, Feisheng Zhong, Xiaohong Liu, Tianbiao Yang, Xiaomin Luo, Kaixian Chen, Hualiang Jiang, Mingyue Zheng, Arne Elofsson

Bioinform., 2020

2019

D3Pockets: A Method and Web Server for Systematic Analysis of Protein Pocket Dynamics.

Zhaoqiang Chen, Xinben Zhang, Cheng Peng, Jinan Wang, Zhijian Xu, Kaixian Chen, Jiye Shi, Weiliang Zhu

J. Chem. Inf. Model., 2019

KinomeX: a web application for predicting kinome-wide polypharmacology effect of small molecules.

Zhaojun Li, Xutong Li, Xiaohong Liu, Zunyun Fu, Zhaoping Xiong, Xiaolong Wu, Xiaoqin Tan, Jihui Zhao, Feisheng Zhong, Xiaozhe Wan, Xiaomin Luo, Kaixian Chen, Hualiang Jiang, Mingyue Zheng

Bioinform., 2019

2017

Combined Virtual Screening and Substructure Search for Discovery of Novel FABP4 Inhibitors.

Haiyan Cai, Ting Wang, Zhuo Yang, Zhijian Xu, Guimin Wang, He-Yao Wang, Weiliang Zhu, Kaixian Chen

J. Chem. Inf. Model., September, 2017

Machine-Learning-Assisted Approach for Discovering Novel Inhibitors Targeting Bromodomain-Containing Protein 4.

Jing Xing, Wenchao Lu, Rongfeng Liu, Yulan Wang, Yiqian Xie, Hao Zhang, Zhe Shi, Hao Jiang, Yu-Chih Liu, Kaixian Chen, Hualiang Jiang, Cheng Luo, Mingyue Zheng

J. Chem. Inf. Model., July, 2017

2016

Discovery of Novel Inhibitors Targeting the Menin-Mixed Lineage Leukemia Interface Using Pharmacophore- and Docking-Based Virtual Screening.

Yuan Xu, Liyan Yue, Yulan Wang, Jing Xing, Zhifeng Chen, Zhe Shi, Rongfeng Liu, Yu-Chih Liu, Xiaomin Luo, Hualiang Jiang, Kaixian Chen, Cheng Luo, Mingyue Zheng

J. Chem. Inf. Model., 2016

Identification of Novel Disruptor of Telomeric Silencing 1-like (DOT1L) Inhibitors through Structure-Based Virtual Screening and Biological Assays.

Shijie Chen, Linjuan Li, Yantao Chen, Junchi Hu, Jingqiu Liu, Yu-Chih Liu, Rongfeng Liu, Yuanyuan Zhang, Fanwang Meng, Kongkai Zhu, Junyan Lu, Mingyue Zheng, Kaixian Chen, Jin Zhang, Hualiang Jiang, Zhiyi Yao, Cheng Luo

J. Chem. Inf. Model., 2016

2014

Halogen Bond: Its Role beyond Drug-Target Binding Affinity for Drug Discovery and Development.

Zhijian Xu, Zhuo Yang, Yingtao Liu, Yunxiang Lu, Kaixian Chen, Weiliang Zhu

J. Chem. Inf. Model., 2014

Estimation of acute oral toxicity in rat using local lazy learning.

Jing Lu, Jianlong Peng, Jinan Wang, Qiancheng Shen, Yi Bi, Likun Gong, Mingyue Zheng, Xiaomin Luo, Weiliang Zhu, Hualiang Jiang, Kaixian Chen

J. Cheminformatics, 2014

In Silico target fishing: addressing a "Big Data" problem by ligand-based similarity rankings with data fusion.

Xian Liu, Yuan Xu, Shanshan Li, Yulan Wang, Jianlong Peng, Cheng Luo, Xiaomin Luo, Mingyue Zheng, Kaixian Chen, Hualiang Jiang

J. Cheminformatics, 2014

<i>In silico</i> site of metabolism prediction for human UGT-catalyzed reactions.

Jianlong Peng, Jing Lu, Qiancheng Shen, Mingyue Zheng, Xiaomin Luo, Weiliang Zhu, Hualiang Jiang, Kaixian Chen

Bioinform., 2014

2012

Estimation of Carcinogenicity Using Molecular Fragments Tree.

Yong Wang, Jing Lu, Fei Wang, Qiancheng Shen, Mingyue Zheng, Xiaomin Luo, Weiliang Zhu, Hualiang Jiang, Kaixian Chen

J. Chem. Inf. Model., 2012

2011

Fragment-based prediction of skin sensitization using recursive partitioning.

Jing Lu, Mingyue Zheng, Yong Wang, Qiancheng Shen, Xiaomin Luo, Hualiang Jiang, Kaixian Chen

J. Comput. Aided Mol. Des., 2011

2009

Efficient Range Query Processing in Peer-to-Peer Systems.

Dongsheng Li, Jiannong Cao, Xicheng Lu, Kaixian Chen

IEEE Trans. Knowl. Data Eng., 2009

2008

An Improved PMF Scoring Function for Universally Predicting the Interactions of a Ligand with Protein, DNA, and RNA.

Xiaoyu Zhao, Xiaofeng Liu, Yuanyuan Wang, Zhi Chen, Ling Kang, Hailei Zhang, Xiaomin Luo, Weiliang Zhu, Kaixian Chen, Honglin Li, Xicheng Wang, Hualiang Jiang

J. Chem. Inf. Model., 2008

PDTD: a web-accessible protein database for drug target identification.

Zhenting Gao, Honglin Li, Hailei Zhang, Xiaofeng Liu, Ling Kang, Xiaomin Luo, Weiliang Zhu, Kaixian Chen, Xicheng Wang, Hualiang Jiang

BMC Bioinform., 2008

2007

Why does beta-secretase zymogen possess catalytic activity? Molecular modeling and molecular dynamics simulation studies.

Zhili Zuo, Chen Gang, Hanjun Zou, Puah Chum Mok, Weiliang Zhu, Kaixian Chen, Hualiang Jiang

Comput. Biol. Chem., 2007

2006

TarFisDock: a web server for identifying drug targets with docking approach.

Honglin Li, Zhenting Gao, Ling Kang, Hailei Zhang, Kun Yang, Kunqian Yu, Xiaomin Luo, Weiliang Zhu, Kaixian Chen, Jianhua Shen, Xicheng Wang, Hualiang Jiang

Nucleic Acids Res., 2006

QSAR analyses on avian influenza virus neuraminidase inhibitors using CoMFA, CoMSIA, and HQSAR.

Mingyue Zheng, Kunqian Yu, Hong Liu, Xiaomin Luo, Kaixian Chen, Weiliang Zhu, Hualiang Jiang

J. Comput. Aided Mol. Des., 2006

Mutagenic probability estimation of chemical compounds by a novel molecular electrophilicity vector and support vector machine.

Mingyue Zheng, Zhiguo Liu, Chunxia Xue, Weiliang Zhu, Kaixian Chen, Xiaomin Luo, Hualiang Jiang

Bioinform., 2006

2005

A New Rapid and Effective Chemistry Space Filter in Recognizing a Druglike Database.

Suxin Zheng, Xiaomin Luo, Gang Chen, Weiliang Zhu, Jianhua Shen, Kaixian Chen, Hualiang Jiang

J. Chem. Inf. Model., 2005

1998

A New Approach to Design Virtual Combinatorial Library with Genetic Algorithm Based on 3D Grid Property.

DongXiang Liu, Hualiang Jiang, Kaixian Chen, RuYun Ji

J. Chem. Inf. Comput. Sci., 1998