Thermophilic proteins: insight and perspective from in silico experiments
نویسندگان
چکیده
منابع مشابه
Mechanistic insight from in silico pharmacokinetic experiments: roles of P-glycoprotein, Cyp3A4 enzymes, and microenvironments.
Saquinavir exhibits paradoxical transport across modified Caco-2 cell monolayers (doi: 10.1124/jpet.103.056390) expressing P-glycoprotein and Cyp3A4. The data implicate complicated intracellular transport mechanisms. Drawing on recent discrete event modeling and simulation advances, we built an in silico analog of the confluent, asymmetric cell monolayer used in the cited work. We call it in si...
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ژورنال
عنوان ژورنال: Chem. Soc. Rev.
سال: 2012
ISSN: 0306-0012,1460-4744
DOI: 10.1039/c1cs15199a