Ab initio study on the noncovalent adsorption of camptothecin anticancer drug onto graphene, defect modified graphene and graphene oxide

Title
Ab initio study on the noncovalent adsorption of camptothecin anticancer drug onto graphene, defect modified graphene and graphene oxide
Authors
Keywords
DFT, Camptothecin, Graphene, Molecular docking, Reactivity descriptors, Drug delivery
Journal
JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN
Volume 27, Issue 9, Pages 807-821
Publisher
Springer Nature
Online
2013-10-16
DOI
10.1007/s10822-013-9681-3

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