Junmei Wang

发表

P-loop Conformation Governed Crizotinib Resistance in G2032R-Mutated ROS1 Tyrosine Kinase: Clues from Free Energy Landscape

Tingjun Hou, Huiyong Sun, Youyong Li, 2014, PLoS Comput. Biol..

Research on port project management maturity model

Junmei Wang, Peiwu Dong, Guohua Qu, 2013, 2013 6th International Conference on Information Management, Innovation Management and Industrial Engineering.

How well does a restrained electrostatic potential (RESP) model perform in calculating conformational energies of organic and biological molecules?

Junmei Wang, Peter A. Kollman, Piotr Cieplak, 2000, J. Comput. Chem..

The Internet of Things and Big Data in the Submarine Cable Release Process of Finite Element Simulation and Matlab Simulation

Junmei Wang, Chao Zhang, 2018, ICCCS.

Genetic Algorithm-Optimized QSPR Models for Bioavailability, Protein Binding, and Urinary Excretion

Junmei Wang, Xiang-Qun Xie, George Krudy, 2006, J. Chem. Inf. Model..

GPCR Structure-Based Virtual Screening Approach for CB2 Antagonist Search

Junmei Wang, Xiang-Qun Xie, Jian-zhong Chen, 2007, J. Chem. Inf. Model..

A Partition-Based Approach to Graph Mining

Mong-Li Lee, Wynne Hsu, Junmei Wang, 2006, 22nd International Conference on Data Engineering (ICDE'06).

Fast, Accurate, and Reliable Protocols for Routine Calculations of Protein–Ligand Binding Affinities in Drug Design Projects Using AMBER GPU-TI with ff14SB/GAFF

Junmei Wang, Tai-Sung Lee, Darrin M York, 2020, ACS omega.

Assessing the performance of the molecular mechanics/Poisson Boltzmann surface area and molecular mechanics/generalized Born surface area methods. II. The accuracy of ranking poses generated from docking

Tingjun Hou, Youyong Li, Junmei Wang, 2011, J. Comput. Chem..

Drug-likeness analysis of traditional Chinese medicines: prediction of drug-likeness using machine learning approaches.

Tingjun Hou, Youyong Li, Sheng Tian, 2012, Molecular pharmaceutics.

Safety Traceability System of Livestock and Poultry Industrial Chain

Junmei Wang, Yong Zheng, Chao Zhang, 2018, ICCCS.

Junmei Wang, Romain M. Wolf, James W. Caldwell, Peter A. Kollman, and David A. Case, "Development and testing of a general amber force field"Journal of Computational Chemistry(2004) 25(9) 1157–1174

Junmei Wang, Peter A. Kollman, David A. Case, 2005, J. Comput. Chem..

Develop and Test a Solvent Accessible Surface Area-Based Model in Conformational Entropy Calculations

Tingjun Hou, Junmei Wang, Junmei Wang, 2012, J. Chem. Inf. Model..

Modeling Compound-Target Interaction Network of Traditional Chinese Medicines for Type II Diabetes Mellitus: Insight for Polypharmacology and Drug Design

Qian Zhang, Tingjun Hou, Youyong Li, 2013, J. Chem. Inf. Model..

Correction to Application of Molecular Dynamics Simulations in Molecular Property Prediction. 1. Density and Heat of Vaporization.

Tingjun Hou, Junmei Wang, 2011, Journal of chemical theory and computation.

A framework for mining topological patterns in spatio-temporal databases

Mong-Li Lee, Wynne Hsu, Junmei Wang, 2005, CIKM '05.

A point‐charge force field for molecular mechanics simulations of proteins based on condensed‐phase quantum mechanical calculations

Wei Zhang, Yong Duan, Rong Yang, 2003, J. Comput. Chem..

MORT: a powerful foundational library for computational biology and CADD

Qian Zhang, Tingjun Hou, Youyong Li, 2014, Journal of Cheminformatics.

Deep convolutional generative adversarial network (dcGAN) models for screening and design of small molecules targeting cannabinoid receptors.

Junmei Wang, Yuemin Bian, Xiang-Qun Xie, 2019, Molecular pharmaceutics.

Traffic Accident Time Series Analysis

Yanyan Wang, Junmei Wang, Weijie Chen, 2018, ICCCS.

Drug-likeness analysis of traditional Chinese medicines: 2. Characterization of scaffold architectures for drug-like compounds, non-drug-like compounds, and natural compounds from traditional Chinese medicines

Lei Chen, Lei Xu, Tingjun Hou, 2013, Journal of Cheminformatics.

Applications of Genetic Algorithms on the Structure-Activity Relationship Analysis of Some Cinnamamides

Tingjun Hou, Junmei Wang, Xiaojie Xu, 1999, J. Chem. Inf. Comput. Sci..

Cheminformatic Insight into the Differences between Terrestrial and Marine Originated Natural Products

Yu Kang, Feng Zhu, Dan Li, 2018, J. Chem. Inf. Model..

Mining in Spatiotemporal Databases

Mong-Li Lee, Wynne Hsu, Junmei Wang, 2005, Spatial Databases.

The application of in silico drug-likeness predictions in pharmaceutical research.

Dan Li, Tingjun Hou, Youyong Li, 2015, Advanced drug delivery reviews.

ADMET Evaluation in Drug Discovery. 11. PharmacoKinetics Knowledge Base (PKKB): A Comprehensive Database of Pharmacokinetic and Toxic Properties for Drugs

Tingjun Hou, Youyong Li, Junmei Wang, 2012, J. Chem. Inf. Model..

Development and testing of a general amber force field

Junmei Wang, Peter A. Kollman, David A. Case, 2004, J. Comput. Chem..

Accelerated Conformational Entropy Calculations Using Graphic Processing Units

Qian Zhang, Tingjun Hou, Youyong Li, 2013, J. Chem. Inf. Model..

[Construction of multi-parameter emergency database and preliminary application research].

Yuzhuo Zhao, Junmei Wang, Wanguo Xue, 2019, Sheng wu yi xue gong cheng xue za zhi = Journal of biomedical engineering = Shengwu yixue gongchengxue zazhi.

ADME Evaluation in Drug Discovery, 8. The Prediction of Human Intestinal Absorption by a Support Vector Machine

Tingjun Hou, Youyong Li, Junmei Wang, 2007, J. Chem. Inf. Model..

Factorial-Quality Scalar and an Extension of ELECTRE in Intuitionistic Fuzzy Sets

Junmei Wang, Guohua Qu, Zengliang Liu, 2017, Int. J. Inf. Technol. Decis. Mak..

Drug-likeness analysis of traditional Chinese medicines: 1. property distributions of drug-like compounds, non-drug-like compounds and natural compounds from traditional Chinese medicines

Qian Li, Tingjun Hou, Youyong Li, 2012, Journal of Cheminformatics.

Automatic parameterization of force field by systematic search and genetic algorithms

Junmei Wang, Peter A. Kollman, P. Kollman, 2001, J. Comput. Chem..

Calculate protein–ligand binding affinities with the extended linear interaction energy method: application on the Cathepsin S set in the D3R Grand Challenge 3

Junmei Wang, Xiang-Qun Xie, Beihong Ji, 2018, Journal of Computer-Aided Molecular Design.

Development and Testing of Druglike Screening Libraries

Junmei Wang, Yubin Ge, Xiang-Qun Xie, 2018, J. Chem. Inf. Model..