A molecular dynamics approach for predicting the glass transition temperature and plasticization effect in amorphous pharmaceuticals

Molecular Pharmaceutics

Volumn 10, Issue 11, 2013, Pages 4136-4145

  Gupta, Jasmine ^a,b   Nunes, Cletus ^b   Jonnalagadda, Sriramakamal ^a  

^a UNIVERSITY OF THE SCIENCES   (United States)

^b BRISTOL MYERS SQUIBB   (United States)

Author keywords

amorphous; drugs; glass transition; modeling; pharmaceutical; plasticization

Indexed keywords

OXYGEN; PLASTICIZER; SUCROSE; WATER;

ARTICLE; COMPUTER MODEL; FORCE; GLASS TRANSITION TEMPERATURE; HYDROGEN BOND; MOLECULAR DYNAMICS; MOLECULAR INTERACTION; PREDICTION; PRIORITY JOURNAL; REGRESSION ANALYSIS; SIMULATION; THEORETICAL MODEL;

GLASS; HYDROGEN BONDING; MOLECULAR DYNAMICS SIMULATION; TEMPERATURE; TRANSITION TEMPERATURE;

EID: 84887386046     PISSN: 15438384     EISSN: 15438392     Source Type: Journal    
DOI: 10.1021/mp400118v     Document Type: Article

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