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"Molecular mechanism for the encapsulation of the doxorubicin in the ..."

Zohre Hasanzade, Heidar Raissi (2020)

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DOI: 10.1016/J.CMPB.2020.105563

access: closed

type: Journal Article

metadata version: 2020-12-25

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Zohre Hasanzade, Heidar Raissi:
Molecular mechanism for the encapsulation of the doxorubicin in the cucurbit[n]urils cavity and the effects of diameter, protonation on loading and releasing of the anticancer drug: Mixed quantum mechanical/ molecular dynamics simulations. Comput. Methods Programs Biomed. 196: 105563 (2020)

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