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Notch strengthening in nanoscale metallic glasses Journal article
Acta Materialia, 2019,Volume: 169,Page: 147-154
Authors:  Sha Z.;  Teng Y.;  Poh L.H.;  Pei Q.;  Xing G.;  Gao H.
Favorite  |  View/Download:3/0  |  Submit date:2019/04/08
Metallic glasses  Molecular dynamics simulation  Notch strengthening  Symmetric notches  
Transdermal Cubic Phases of Metformin Hydrochloride: In Silico and in Vitro Studies of Delivery Mechanisms Journal article
MOLECULAR PHARMACEUTICS, 2018,Volume: 15,Issue: 8,Page: 3121-3132
Authors:  Yu, Xiang;  Jin, Yiguang;  Du, Lina;  Sun, Mengchi;  Wang, Jian;  Li, Qiu;  Zhang, Xiangyu;  Gao, Zisen;  Ding, Pingtian
Favorite  |  View/Download:18/0  |  Submit date:2018/10/30
computational simulation  cubic phase  dissipative particle dynamics  metformin hydrochloride  molecular interaction  transdermal delivery  
Computer-Aided Formulation Design for a Highly Soluble Lutein-Cyclodextrin Multiple-Component Delivery System Journal article
MOLECULAR PHARMACEUTICS, 2018,Volume: 15,Issue: 4,Page: 1664-1673
Authors:  Zhao, Qianqian;  Miriyala, Nikhila;  Su, Yan;  Chen, Weijie;  Gao, Xuejiao;  Shao, Ling;  Yan, Ru;  Li, Haifeng;  Yao, Xiaojun;  Cao, Dongsheng;  Wang, Yitao;  Ouyang, Defang
View  |  Adobe PDF(4697Kb)  |  Favorite  |  View/Download:134/19  |  Submit date:2018/10/30
Lutein  Cyclodextrin  Multiple-component System  Molecular Dynamics Simulation  Bioavailability  Computer-aided Formulation Design  
Drug-loaded pH-responsive polymeric micelles: Simulations and experiments of micelle formation, drug loading and drug release Journal article
COLLOIDS AND SURFACES B-BIOINTERFACES, 2017,Volume: 158,Page: 709-716
Authors:  Li, Qiu;  Yao, Weishang;  Yu, Xiang;  Zhang, Baolei;  Dong, Junxing;  Jin, Yiguang
Favorite  |  View/Download:15/0  |  Submit date:2018/10/30
Block copolymer  Computer simulation  pH-responsive  Polymeric micelles  Paclitaxel  Molecular dynamics  Coarse grain  Dissipative particle dynamics  
Exploring the behaviour of water nanodroplet on a coplanar electrowetting-on-dielectric: a molecular dynamics approach Journal article
MICRO & NANO LETTERS, 2017,Volume: 12,Issue: 7,Page: 486-489
Authors:  Chan, Hoi Kei;  Mak, Pui In;  Siu, Shirley W. I.
Favorite  |  View/Download:7/0  |  Submit date:2018/10/30
water  drops  wetting  molecular dynamics method  hydrogen bonds  contact angle  water nanodroplet  coplanar electrowetting-on-dielectric  molecular dynamics simulation  hydrophobic surface  applied electric field  open-plate coplanar electrodes system  electrode-induced field  contact angle  hydrogen bonding  diffusion coefficient  water molecules  hydration layer  water diffusion  
The effect of pH on PAMAM dendrimer-siRNA complexation - Endosomal considerations as determined by molecular dynamics simulation Journal article
Biophysical Chemistry, 2011,Volume: 158,Issue: 2-3,Page: 126-133
Authors:  Ouyang D.;  Zhang H.;  Parekh H.S.;  Smith S.C.
Favorite  |  View/Download:1/0  |  Submit date:2019/01/15
Dendrimer  Endosome  Gene Delivery  Molecular Dynamics Simulation  Proton Sponge Theory  Sirna