Dongsheng Cao
Alma Mater:Central South University
Journal Publications
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Multi-analytical strategy for unassigned peaks using physical/mathematical separation, fragmental rules and retention index prediction: An example of sesquiterpene metabolites characterization in Cyperus rotundus[J].Journal of pharmaceutical and biomedical analysis, 2018, 154: 476-485.
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ECoFFeS: A software using evolutionary computation for feature selection in drug discovery[J].IEEE Access, 2018, 6: 20950-20963.
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Computer-aided formulation design for a highly soluble lutein–cyclodextrin multiple-component delivery system[J].Molecular pharmaceutics, 2018, 15 (4) : 1664-1673.
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Inhibitory effects of Sichuan pepper (Zanthoxylum bungeanum) and sanshoamide extract on heterocyclic amine formation in grilled ground beef patties[J].Food chemistry, 2018, 239: 111-118.
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ChemBCPP: a freely available web server for calculating commonly used physicochemical properties[J].Chemometrics and Intelligent Laboratory Systems, 2017, 171: 65-73.
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A strategy on the definition of applicability domain of model based on population analysis[J].Chemometrics and Intelligent Laboratory Systems, 2017, 170: 77-83.
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ADME properties evaluation in drug discovery: Prediction of plasma protein binding using NSGA-II combining PLS and consensus modeling[J].Chemometrics and Intelligent Laboratory Systems, 2017, 170: 84-95.
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The hybrid of semisupervised manifold learning and spectrum kernel for classification[J].Journal of Chemometrics, 2017, 32 (2) : e2955.
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Inhibitory profiles of spices against free and protein-bound heterocyclic amines of roast beef patties as revealed by ultra-performance liquid chromatography–tandem mass spectrometry and principal component analysis[J].Food & function, 2017, 8 (11) : 3938-3950.
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Multi-target screening and experimental validation of natural products from selaginella plants against Alzheimer's disease[J].Frontiers in pharmacology, 2017, 8: 539.
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Ensemble partial least squares regression for descriptor selection, outlier detection, applicability domain assessment, and ensemble modeling in QSAR/QSPR modeling[J].Journal of Chemometrics, 2017, 31 (11) : e2922.
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Predicting human intestinal absorption with modified random forest approach: a comprehensive evaluation of molecular representation, unbalanced data, and applicability domain issues[J].RSC advances, 2017, 7 (31) : 19007 - 19018.
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ChemSAR: an online pipelining platform for molecular SAR modeling[J].Journal of cheminformatics, 2017, 9 (1) : 1-13.
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BioMedR: R/Bioconductor Package for generating various molecular representations for chemicals, proteins, DNAs/RNAs and their interactions[J].Journal of chemometrics, 2017, 8 (34)
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Label-free, Water-soluble Fluorescent Peptide Probe for a Sensitive and Selective Determination of Copper Ions[J].Analytical Sciences, 2017, 33 (33) : 191-196.
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Seladoeflavones A-F, six novel flavonoids from Selaginella doederleinii[J].Fitoterapia, 2017, 116 (116) : 66-71.
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Selagintriflavonoids with BACE1 inhibitory activity from the fern Selaginella doederleinii[J].Phytochemistry, 2017, 134 (134) : 114-121.
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BioTriangle: a web-accessible platform for generating various molecular representations for chemicals, proteins, DNAs/RNAs and their interactions[J].Journal of cheminformatics, 2016, 8 (1) : 1-13.
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BioTriangle: a web-accessible platform for generating various molecular representations for chemicals, proteins, DNAs/RNAs and their interactions[J].Journal of cheminformatics, 2016, 8 (34)
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TargetNet: a web service for predicting potential drug–target interaction profiling via multi-target SAR models[J].Journal of computer-aided molecular design, 2016, 30 (5) : 413-424.