|
Selected(0)Clear
Items/Page: Sort: |
| 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]:0 TC[Scopus]:0 | Submit date：2021/03/02
Dissolution profile Machine learning molecular dynamics (MD) simulations Pharmacokinetic modeling Solid dispersion |
| Can machine learning predict drug nanocrystals? Journal article
Journal of Controlled Release, 2020,Volume: 322,Page: 274-285
Authors: He，Yuan; Ye，Zhuyifan; Liu，Xinyang; Wei，Zhengjie; Qiu，Fen; Li，Hai Feng; Zheng，Ying; Ouyang，Defang
Favorite | | TC[WOS]:2 TC[Scopus]:3 | Submit date：2021/03/01
Machine learning Nanocrystals Particle size Polydispersity index (PDI) Prediction |
| 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]:2 TC[Scopus]:2 | Submit date：2021/03/02 |
| Predicting complexation performance between cyclodextrins and guest molecules by integrated machine learning and molecular modeling techniques Journal article
Acta Pharmaceutica Sinica B, 2019,Volume: 9,Issue: 6,Page: 1241-1252
Authors: Zhao，Qianqian; Ye，Zhuyifan; Su，Yan; Ouyang，Defang
Favorite | | TC[WOS]:12 TC[Scopus]:15 | Submit date：2021/03/02
Binding free energy Cyclodextrin Deep learning Ketoprofen LightGBM Machine learning Molecular modeling Random forest |
| Predicting physical stability of solid dispersions by machine learning techniques Journal article
Journal of Controlled Release, 2019,Volume: 311-312,Page: 16-25
Authors: Han，Run; Xiong，Hui; Ye，Zhuyifan; Yang，Yilong; Huang，Tianhe; Jing，Qiufang; Lu，Jiahong; Pan，Hao; Ren，Fuzheng; Ouyang，Defang
Favorite | | TC[WOS]:22 TC[Scopus]:22 | Submit date：2021/03/02
Machine learning Molecular modeling Physical stability Solid dispersion |
