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Molecular dynamics simulation of interaction between phospholipid membrane and pyrazine and its derivatives

✍ Scribed by A. A. Mamonov, B. F. Shchegolev…


Book ID
120952065
Publisher
SP MAIK Nauka/Interperiodica
Year
2013
Tongue
English
Weight
689 KB
Volume
7
Category
Article
ISSN
1990-7478

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The interactions of benzotriazole (BTA) and 1-hydroxybenzotriazole (1-OH-BTA) with cuprous oxide (Cu 2 O) crystal have been simulated by molecular dynamics in water solution. The results show that both BTA and 1-OH-BTA can bind tightly with Cu 2 O in water environment. Under different temperatures,