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Physical Chemistry Chemical Physics : PCCP|May 12, 2020
The misfolding mechanism of the key fragment R3 of tau protein: a combined molecular dynamics simulation and Markov state model studyHongli Liu, Haiyang Zhong, Zerong Xu, et al.Physical Chemistry Chemical Physics : PCCP|November 9, 2019
Importance of a crystalline water network in docking-based virtual screening: a case study of BRD4Haiyang Zhong, Zhe Wang, Xuwen Wang, et al.Physical Chemistry Chemical Physics : PCCP|February 27, 2020
Binding affinity and dissociation pathway predictions for a series of USP7 inhibitors with pyrimidinone scaffold by multiple computational methodsZhe Wang, Xuwen Wang, Yu Kang, et al.Journal of Nanoscience and Nanotechnology|May 13, 2008
Quantum efficiency and surface passivation effect of nanocrystalline Y2O3:Eu3+Baojiu Chen, Qingyu Meng, Haiyang Zhong, et al.Journal of Chemical Information and Modeling|October 26, 2023
Small-Molecule Conformer Generators: Evaluation of Traditional Methods and AI Models on High-Quality Data SetsZhe Wang, Haiyang Zhong, Jintu Zhang, et al.Journal of Nanoscience and Nanotechnology|March 15, 2012
Nitrogen doped ZnO thin films prepared by photo-assisted metal-organic chemical vapor depositionXiangping Li, Rensheng Shen, Baolin Zhang, et al.Briefings in Bioinformatics|January 27, 2020
Can machine learning consistently improve the scoring power of classical scoring functions? Insights into the role of machine learning in scoring functionsChao Shen, Ye Hu, Zhe Wang, et al.Journal of Nanoscience and Nanotechnology|March 15, 2012
Fabrication and luminescent enhancement of Eu3+-doped Y2O3@YOF core-shell nanocrystalsYue Tian, Baojiu Chen, Ruinian Hua, et al.Journal of Medicinal Chemistry|December 28, 2023
Discovery of Novel Inhibitors of BRD4 for Treating Prostate Cancer: A Comprehensive Case Study for Considering Water Networks in Virtual Screening and Drug DesignHaiyang Zhong, Xinyue Wang, Shicheng Chen, et al.Journal of Cheminformatics|October 17, 2021
The impact of cross-docked poses on performance of machine learning classifier for protein-ligand binding pose predictionChao Shen, Xueping Hu, Junbo Gao, et al.Pageof 4