Tiejun Cheng

发表

Investigating the correlations among the chemical structures, bioactivity profiles and molecular targets of small molecules

Yanli Wang, Stephen H. Bryant, Tiejun Cheng, 2010, Bioinform..

FSelector: a Ruby gem for feature selection

Yanli Wang, Stephen H. Bryant, Tiejun Cheng, 2012, Bioinform..

Risk scenario prediction for sudden water pollution accidents based on Bayesian networks

Tiejun Cheng, Panpan Wang, Qianyi Lu, 2018, Int. J. Syst. Assur. Eng. Manag..

PubChem BioAssay: 2014 update

Yanli Wang, Jian Zhang, Benjamin A. Shoemaker, 2013, Nucleic Acids Res..

A knowledge-guided strategy for improving the accuracy of scoring functions in binding affinity prediction

Zhihai Liu, Tiejun Cheng, Renxiao Wang, 2010, BMC Bioinformatics.

Research on the adaptability evaluation model for emergency response plan based on 2-tuple linguistic

Qianli Xu, Tiejun Cheng, Fengping Wu, 2017, Int. J. Syst. Assur. Eng. Manag..

A Dynamic Decision Making Methodology for Emergency Response

Tiejun Cheng, 2014 .

Binary Classification of Aqueous Solubility Using Support Vector Machines with Reduction and Recombination Feature Selection

Yanli Wang, Stephen H. Bryant, Tiejun Cheng, 2011, J. Chem. Inf. Model..

Comparative Assessment of Scoring Functions on a Diverse Test Set

Zhihai Liu, Yan Li, Xun Li, 2009, J. Chem. Inf. Model..

Literature information in PubChem: associations between PubChem records and scientific articles

Evan Bolton, Yanli Wang, Bo Yu, 2016, Journal of Cheminformatics.

PUG-View: programmatic access to chemical annotations integrated in PubChem

Jian Zhang, Tiejun Cheng, Sunghwan Kim, 2019, Journal of Cheminformatics.

Pathway Analysis for Drug Repositioning Based on Public Database Mining

Yanli Wang, Stephen H. Bryant, Tiejun Cheng, 2014, J. Chem. Inf. Model..

Identifying Compound-Target Associations by Combining Bioactivity Profile Similarity Search and Public Databases Mining

Yanli Wang, Stephen H. Bryant, Tiejun Cheng, 2011, J. Chem. Inf. Model..

Automatic Perception of Organic Molecules Based on Essential Structural Information

Yuan Zhao, Tiejun Cheng, Renxiao Wang, 2007, J. Chem. Inf. Model..

PubChem applications in drug discovery: a bibliometric analysis.

Yanli Wang, Tiejun Cheng, Stephen H Bryant, 2014, Drug discovery today.

PubChem BioAssay: 2017 update

Yanli Wang, Jian Zhang, Benjamin A. Shoemaker, 2016, Nucleic Acids Res..

Structure-Based Virtual Screening for Drug Discovery: a Problem-Centric Review

Yanli Wang, Stephen H. Bryant, Tiejun Cheng, 2012, The AAPS Journal.

PubChem BioAssay: A Decade’s Development toward Open High-Throughput Screening Data Sharing

Yanli Wang, Stephen H. Bryant, Tiejun Cheng, 2017, SLAS discovery : advancing life sciences R & D.

An update on PUG-REST: RESTful interface for programmatic access to PubChem

Evan Bolton, Bo Yu, Tiejun Cheng, 2018, Nucleic Acids Res..

Predicting drug–drug interactions through drug structural similarities and interaction networks incorporating pharmacokinetics and pharmacodynamics knowledge

Yanli Wang, Ming Hao, Stephen H. Bryant, 2017, Journal of Cheminformatics.

Evaluation of the performance of four molecular docking programs on a diverse set of protein‐ligand complexes

Zhihai Liu, Yan Li, Xun Li, 2010, J. Comput. Chem..

PubChem 2019 update: improved access to chemical data

Evan Bolton, Bo Yu, Jie Chen, 2018, Nucleic Acids Res..

Supporting precision medicine by data mining across multi‐disciplines: an integrative approach for generating comprehensive linkages between single nucleotide variants (SNVs) and drug‐binding sites

Yanli Wang, Stephen H. Bryant, Tiejun Cheng, 2017, Bioinform..

Computation of Octanol-Water Partition Coefficients by Guiding an Additive Model with Knowledge

Yuan Zhao, Yong Xu, Yan Li, 2007, J. Chem. Inf. Model..

Large-Scale Prediction of Drug-Target Interaction: a Data-Centric Review

Yanli Wang, Stephen H. Bryant, Tiejun Cheng, 2017, The AAPS Journal.

Discovering and Summarizing Relationships Between Chemicals, Genes, Proteins, and Diseases in PubChem

Tiejun Cheng, Sunghwan Kim, Leonid Zaslavsky, 2021, Frontiers in Research Metrics and Analytics.

I-SOLV: a new surface-based empirical model for computing solvation free energies.

Tiejun Cheng, Renxiao Wang, Tiejun Cheng, 2007, Journal of molecular graphics & modelling.

Characterizing protein domain associations by Small-molecule ligand binding.

Tiejun Cheng, Stephen H Bryant, Qingliang Li, 2012, Journal of proteome science and computational biology.

Plant Reactome: a knowledgebase and resource for comparative pathway analysis

Evan Bolton, Irene Papatheodorou, Tiejun Cheng, 2019, Nucleic Acids Res..

Automatic Perception of Organic Molecules Based on Essential Structural Information.

Tiejun Cheng, Renxiao Wang, Tiejun Cheng, 2007 .