Molecular dynamics simulation of drug uptake by polymer

Journal of Molecular Modeling

Volumn 17, Issue 5, 2011, Pages 1141-1147

  Subashini, M ^a   Devarajan, Padma V ^b   Sonavane, Ganeshchandra S ^b   Doble, Mukesh ^a  

^a INDIAN INSTITUTE OF TECHNOLOGY MADRAS   (India)

^b INSTITUTE OF CHEMICAL TECHNOLOGY   (India)

Author keywords

Drugs polymer interaction; Hydrophobic interaction; Interaction energy; Molecular dynamics simulation

Indexed keywords

ALGINIC ACID; CHITOSAN; DOXORUBICIN; EUDRAGIT; GANTREZ COPOLYMER; GLICLAZIDE; HYDROGEN; POLYMER; SILYMARIN; WATER;

ARTICLE; DIPOLE; DRUG STRUCTURE; DRUG UPTAKE; ENERGY; HYDROGEN BOND; HYDROPHILICITY; MOLECULAR DYNAMICS; MOLECULAR MECHANICS; PRIORITY JOURNAL;

DOXORUBICIN; DRUG DELIVERY SYSTEMS; GLICLAZIDE; HYDROPHOBIC AND HYDROPHILIC INTERACTIONS; MODELS, MOLECULAR; MOLECULAR DYNAMICS SIMULATION; NANOPARTICLES; POLYMERS; SILYMARIN; SOLUBILITY; THERMODYNAMICS; WATER;

EID: 79958085592     PISSN: 16102940     EISSN: 09485023     Source Type: Journal    
DOI: 10.1007/s00894-010-0811-8     Document Type: Article

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