Xinliang Yu

发表

Support vector machine-based QSPR for the prediction of glass transition temperatures of polymers

Xinliang Yu, 2010 .

Prediction of the thermal decomposition property of polymers using quantum chemical descriptors

F. Liu, B. Yi, Xinliang Yu, 2007 .

Prediction of enantioselectivity in thiol addition to imines catalyzed by chiral phosphoric acids

Xinliang Yu, 2022, Journal of Physical Organic Chemistry.

Support Vector Machine Classification of Streptavidin-Binding Aptamers

Xinliang Yu, Yixiong Yu, Qun Zeng, 2014, PloS one.

A Mathematical Analysis of the Selective Enrichment of NECEEM-Based Non-SELEX

Xinliang Yu, Yixiong Yu, 2014, Applied Biochemistry and Biotechnology.

Pattern recognition of enrichment levels of SELEX-based candidate aptamers for human C-reactive protein

R. Yu, Xiaohai Yang, Xinliang Yu, 2017, Biomedizinische Technik. Biomedical engineering.

Correlation between 13C NMR chemical shifts and complete sets of descriptors of natural coumarin derivatives

Xinliang Yu, Lisha Xu, Yali Zhu, 2019, Chemometrics and Intelligent Laboratory Systems.

Prediction of chemical toxicity to Tetrahymena pyriformis with four-descriptor models.

Xinliang Yu, 2020, Ecotoxicology and environmental safety.

Prediction of the Q–e parameters from transition state structures

R. Yu, Xinliang Yu, 2013 .

Support Vector Machine‐Based Prediction of Enantioselectivity in Fluorination of Allylic Alcohols

Xinliang Yu, 2022, ChemistrySelect.

A quantitative relationship between Tgs and chain segment structures of polystyrenes

Xianwei Huang, Xinliang Yu, 2017 .

Prediction of the glass transition temperatures of styrenic copolymers using a QSPR based on the DFT method

Xinliang Yu, Xueye Wang, Hanlu Wang, 2006 .

Prediction of glass transition temperatures of polyacrylates from the structures of motion units

Xianwei Huang, Xinliang Yu, 2016 .

DFT-based quantum theory QSPR studies of molar heat capacity and molar polarization of vinyl polymers

B. Yi, Xinliang Yu, Xueye Wang, 2008 .

Correlation between the glass transition temperatures and multipole moments for polymers

B. Yi, Xinliang Yu, Zhiming Xie, 2007 .

Prediction of polyamide properties using quantum-chemical methods and BP artificial neural networks

Jinwei Gao, Xinliang Yu, Xueye Wang, 2006, Journal of molecular modeling.

Prediction of Solubility Parameters for Polymers by a QSPR Model

Jinwei Gao, Xinliang Yu, Xueye Wang, 2006 .

Novel Method for Structure–Activity Relationship of Aptamer Sequences for Human Prostate Cancer

Xianwei Huang, Xinliang Yu, Huiqiong Yang, 2018, ACS omega.

Prediction of the maximum nonseizure load of lubricant additives

Xianwei Huang, Jiyong Deng, Xinliang Yu, 2017 .

Computer-aided design of aptamers for SMMC-7721 liver carcinoma cells

Jiyong Deng, Xinliang Yu, Qiuping Guo, 2017 .

Recognition of candidate aptamer sequences for human hepatocellular carcinoma in SELEX screening using structure–activity relationships

Kemin Wang, Xiaohai Yang, Yu Zhou, 2014 .

Theoretical study on a multifunctional electroluminescent molecule Mes2B[p-4,4′-biphenyl-Nph(1-naphthyl)]

Jinwei Gao, Xinliang Yu, Xueye Wang, 2006 .

Prediction of rate constants for the reactions of alkanes with the hydroxyl radicals

Xianwei Huang, B. Yi, Xinliang Yu, 2012, Journal of Atmospheric Chemistry.

Prediction of Depuration Rate Constants for Polychlorinated Biphenyl Congeners

Xinliang Yu, 2019, ACS omega.

Setschenow Constant Prediction Based on the IEF-PCM Calculations

R. Yu, Xinliang Yu, 2013 .

DFT-based quantum theoretic QSPR studies of the glass transition temperatures of polyacrylates

Xinliang Yu, Wenhao Yu, X. Yu, 2009 .

Prediction of the conformational property for polymers using quantum chemical descriptors

B. Yi, Xinliang Yu, Zhiming Xie, 2007 .

Prediction of the dielectric dissipation factor tanδ of polymers with an ANN model based on the DFT calculation

B. Yi, Xinliang Yu, Xueye Wang, 2008 .

PREDICTION OF RATE CONSTANTS FOR NITRATE RADICAL REACTIONS USING A SVM MODEL BASED ON DENSITY FUNCTIONAL THEORY

Jiyong Deng, B. Yi, Xinliang Yu, 2014 .

PREDICTION OF REACTION RATE CONSTANTS OF HYDROXYL RADICAL WITH ORGANIC COMPOUNDS

Xianwei Huang, Xinliang Yu, Shihua Zhang, 2014 .

QSAR models of reaction rate constants of alkenes with ozone and hydroxyl radical

Xinliang Yu, Shihua Zhang, Yueyu Xu, 2013 .

Random forest algorithm-based accurate prediction of rat acute oral toxicity

Xianwei Huang, Jiyong Deng, Xinliang Yu, 2022, Molecular Physics.

Predicting rate constants of hydroxyl radical reactions with alkenes and aromatics

Jiyong Deng, B. Yi, Xinliang Yu, 2015, Journal of Atmospheric Chemistry.

Removal of Organic Dyes by Nanostructure ZnO-Bamboo Charcoal Composites with Photocatalysis Function

Aimiao Qin, N. Tian, Lei Liao, 2015 .

A simple three‐descriptor model for the prediction of the glass‐transition temperatures of vinyl polymers

Xinliang Yu, Xueye Wang, Wenhao Yu, 2010 .

Prediction of Glass Transition Temperatures for Polystyrenes by a Four‐Descriptors QSPR Model

Xinliang Yu, Jinwei Gao, Hanlu Wang, 2006 .

PREDICTION OF THE GLASS TRANSITION TEMPERATURES FOR POLYMERS WITH ARTIFICIAL NEURAL NETWORK

B. Yi, Xinliang Yu, Xueye Wang, 2008 .

A novel nucleic acid sequence encoding strategy for high-performance aptamer identification and the aid of sequence design and optimization

Qin Yang, Sui-Ping Wang, Xinliang Yu, 2017 .

A support vector machine model for the prediction of monomer reactivity ratios

Xinliang Yu, Xueye Wang, 2011 .

PREDICTION OF MONOMER REACTIVITY RATIOS IN RADICAL COPOLYMERIZATION OF VINYL MONOMERS

B. Yi, Xinliang Yu, Xueye Wang, 2009 .

Quantitative structure–property relationships for the reactivity parameters of acrylate monomers

Bing Yi, Xinliang Yu, B. Yi, 2008 .

Predicting reaction rate constants of ozone with organic compounds from radical structures

Bing Yi, Xinliang Yu, Jianfang Chen, 2012 .

Machine learning-based prediction of toxicity of organic compounds towards fathead minnow

Xinliang Yu, Xianwei Huang, Xianwei Huang, 2020, RSC advances.

Prediction of refractive index of vinyl polymers by using density functional theory

Bing Yi, Xinliang Yu, Xueye Wang, 2007, J. Comput. Chem..

Coprecipitation-Gel Synthesis and Degradation Mechanism of Octahedral Li1.2Mn0.54Ni0.13Co0.13O2 as High-Performance Cathode Materials for Lithium-Ion Batteries.

Jianguo Liu, Liang Zhou, Wuwei Yan, 2018, ACS applied materials & interfaces.

Prediction of the half-lives of polychlorinated biphenyls based on the IEF-PCM calculations

Xianwei Huang, Jianfang Chen, Xinliang Yu, 2019, Journal of Theoretical and Computational Chemistry.

Prediction of the onset temperature of decomposition of lubricant additives

Xinliang Yu, Lei Huang, 2017, Journal of Thermal Analysis and Calorimetry.

Preparation and Charaterization of Poly(1,4–Butanediol-Citrate) Elastomers and CdTe/Poly(1,4–Butanediol-Citrate) Composite Bioelastomers

Aimiao Qin, Lei Liao, Xinliang Yu, 2014 .

Theoretical Design of a New Allosteric Switch and Fluorescence Chemosensor Double Functional Devices of Aza-Crown Ether

Xinliang Yu, Xueye Wang, Weiwei Li, 2017 .

A novel polymer gel electrolyte based on cyanoethylated cellulose for dye-sensitized solar cells

Songting Tan, Xianwei Huang, Yijiang Liu, 2012 .

Prediction of glass transition temperatures of aromatic heterocyclic polymers

Xinliang Yu, Xueye Wang, 2012 .

Calculation of polyamides melting point by quantum-chemical method and BP artificial neural networks

Jinwei Gao, Xinliang Yu, Xueye Wang, 2006, Journal of molecular modeling.

DFT-based theoretical QSPR models of Q-e parameters for the prediction of reactivity in free-radical copolymerizations

Xinliang Yu, Wanqiang Liu, Xueye Wang, 2008, Journal of molecular modeling.

Prediction of the polarity parameter from transition state structures of radical polymerization of vinyl monomers

Xinliang Yu, 2013, Polymer Science Series B.

Prediction of the Q-e parameters from radical structures

Xinliang Yu, Xueye Wang, Bo Li, 2010 .

Artificial neural network prediction of steric hindrance parameter of polymers

B. Yi, Xinliang Yu, Xueye Wang, 2009 .

Prediction of inhibitory constants of compounds against SARS-CoV 3CLpro enzyme with 2D-QSAR model

Xinliang Yu, 2021, Journal of Saudi Chemical Society.

Quantitative structure–property relationship studies of polymeric cohesive energy by density functional theory

Jinwei Gao, Xinliang Yu, Xueye Wang, 2006 .

QSPR studies of polyvinyls by density functional theory

Jinwei Gao, Xinliang Yu, Xueye Wang, 2005 .

Biomass carbon derived from sisal fiber as anode material for lithium-ion batteries

Kaiyou Zhang, Aimiao Qin, Yu Xinliang, 2015 .

Random forest algorithm-based accurate prediction of chemical toxicity to Tetrahymena pyriformis.

Zhengjun Fang, Xinliang Yu, Qun Zeng, 2022, Toxicology.

Complete sets of descriptors for the prediction of 13C NMR chemical shifts of quinoline derivatives

Xinliang Yu, L. Dang, 2018, Journal of Chemometrics.

QSPR model for solvation enthalpy based on quantum chemical descriptors

Jiyong Deng, Xinliang Yu, Hanlu Wang, 2023, Journal of Molecular Liquids.

QSPR-based model extrapolation prediction of enthalpy of solvation

Xinliang Yu, W. Acree Jr., 2023, Journal of Molecular Liquids.

Random forest algorithm-based classification model of pesticide aquatic toxicity to fishes.

Xinliang Yu, Qun Zeng, 2022, Aquatic toxicology.

Quantitative structure-toxicity relationships of organic chemicals against Pseudokirchneriella subcapitata.

Xinliang Yu, 2020, Aquatic toxicology.

Random Forest Algorithm-Based Prediction of Solvation Gibbs Energies

Xinliang Yu, Le Zhao, Jiannan Zhou, 2023, Journal of Solution Chemistry.

Support vector machine-based model for toxicity of organic compounds against fish.

Xinliang Yu, 2021, Regulatory toxicology and pharmacology : RTP.

Global classification models for predicting acute toxicity of chemicals towards Daphnia magna.

Xinliang Yu, 2023, Environmental research.

Identifying protein arginine methylation sites using global features of protein sequence coupled with support vector machine optimized by particle swarm optimization algorithm

Qin Yang, Jian-Hui Jiang, Hai-Long Wu, 2015 .

Large Dataset-Based Regression Model of Chemical Toxicity to Vibrio fischeri

Xinliang Yu, L. Su, Minghui He, 2023, Archives of Environmental Contamination and Toxicology.

Prediction of reaction rate constants of hydroxyl radical with chemicals in water

Xinliang Yu, Jun Liu, 2020, Water environment research : a research publication of the Water Environment Federation.