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In silico formulation prediction of drug/cyclodextrin/polymer ternary complexes by machine learning and molecular modeling techniques Journal article
Carbohydrate Polymers, 2022,Volume: 275
Authors:  Li, Junjun;  Gao, Hanlu;  Ye, Zhuyifan;  Deng, Jiayin;  Ouyang, Defang
Favorite |  | TC[WOS]:0 TC[Scopus]:0 | Submit date:2022/02/21
Machine Learning  Molecular Modeling  Random Forest  Solubility Prediction  Ternary Cyclodextrin Complexes  
Prediction of lipid nanoparticles for mRNA vaccines by the machine learning algorithm Journal article
Acta Pharmaceutica Sinica B, 2022
Authors:  Wang, Wei;  Feng, Shuo;  Ye, Zhuyifan;  Gao, Hanlu;  Lin, Jinzhong;  Ouyang, Defang
Favorite |  | TC[WOS]:0 TC[Scopus]:1 | Submit date:2022/05/17
Formulation prediction  Ionizable lipid  LightGBM  Lipid nanoparticle  Machine learning  Molecular modeling  mRNA  Vaccine  
The important herbal pair for the treatment of COVID-19 and its possible mechanisms Journal article
Chinese Medicine (United Kingdom), 2021,Volume: 16,Issue: 1
Authors:  Xia, Shujie;  Zhong, Zhangfeng;  Gao, Bizhen;  Vong, Chi Teng;  Lin, Xuejuan;  Cai, Jin;  Gao, Hanlu;  Chan, Ging;  Li, Candong
Favorite |  | TC[WOS]:8 TC[Scopus]:11 | Submit date:2021/12/09
Amygdalus Communis Vas  Association Rules  Ephedra Sinica Stapf  Herbal Pair  Molecular Docking  Network Pharmacology  Novel Coronavirus Pneumonia  
Computational pharmaceutics - A new paradigm of drug delivery Journal article
Journal of Controlled Release, 2021,Volume: 338,Page: 119-136
Authors:  Wang, Wei;  Ye, Zhuyifan;  Gao, Hanlu;  Ouyang, Defang
Favorite |  | TC[WOS]:9 TC[Scopus]:12 | Submit date:2021/12/08
Artificial Intelligence  Computational Pharmaceutics  Machine Learning  Mathematical Modeling  Molecular Modeling  Pbpk Modeling  Process Simulation  
PharmSD: A novel AI-based computational platform for solid dispersion formulation design Journal article
International Journal of Pharmaceutics, 2021,Volume: 604
Authors:  Dong, Jie;  Gao, Hanlu;  Ouyang, Defang
Favorite |  | TC[WOS]:1 TC[Scopus]:4 | Submit date:2021/12/08
Computational Platform  Drug Design  Formulation  Machine Learning  Solid Dispersion  Web Server  
Using Acetone/Water Binary Solvent to Enhance the Stability and Bioavailability of Spray Dried Enzalutamide/HPMC-AS Solid Dispersions Journal article
Journal of Pharmaceutical Sciences, 2021,Volume: 110,Issue: 3,Page: 1160-1171
Authors:  Zhang,Xiaoting;  Rao,Qiuhong;  Qiu,Zhenwen;  Lin,Yisheng;  Zhang,Lei;  Hu,Qingzhong;  Chen,Tingting;  Ma,Zhimin;  Gao,Hanlu;  Luo,Dandong;  Zhao,Jiaqi;  Ouyang,Defang;  Zhang,Zhenyu Jason;  Li,Qingguo
Favorite |  | TC[WOS]:4 TC[Scopus]:4 | Submit date:2021/03/02
Amorphous Solid Dispersion  Drug-excipient Interaction  Particle Size  Poorly Water-soluble Drug  Spray Drying  
An integrated computational methodology with data-driven machine learning, molecular modeling and PBPK modeling to accelerate solid dispersion formulation design Journal article
European Journal of Pharmaceutics and Biopharmaceutics, 2021,Volume: 158,Page: 336-346
Authors:  Gao,Hanlu;  Wang,Wei;  Dong,Jie;  Ye,Zhuyifan;  Ouyang,Defang
Favorite |  | TC[WOS]:11 TC[Scopus]:14 | Submit date:2021/03/02
Dissolution Profile  Machine Learning  Molecular Dynamics (Md) Simulations  Pharmacokinetic Modeling  Solid Dispersion  
Predicting drug/phospholipid complexation by the lightGBM method Journal article
Chemical Physics Letters, 2020,Volume: 747
Authors:  Gao,Haoshi;  Ye,Zhuyifan;  Dong,Jie;  Gao,Hanlu;  Yu,Hua;  Li,Haifeng;  Ouyang,Defang
Favorite |  | TC[WOS]:13 TC[Scopus]:13 | Submit date:2021/03/02
The novel platinum(IV) prodrug with self-assembly property and structure-transformable character against triple-negative breast cancer Journal article
Biomaterials, 2020,Volume: 232
Authors:  Yang,Conglian;  Tu,Kun;  Gao,Hanlu;  Zhang,Liao;  Sun,Yu;  Yang,Ting;  Kong,Li;  Ouyang,Defang;  Zhang,Zhiping
Favorite |  | TC[WOS]:17 TC[Scopus]:17 | Submit date:2021/03/02
Adjudin  Drug Resistance  Platinum(Iv) Prodrug  Self-assembly  Structure Transform  Triple-negative Breast Cancer