Molecular and electronic properties of HIV-1 protease inhibitor C<inf>60</inf>derivatives as studied by the ONIOM method

Molecular and electronic properties of HIV-1 protease inhibitor C<inf>60</inf>derivatives as studied by the ONIOM method

Quantum chemical methods were performed to study the structure and electronic properties of a series of C60derivatives. The integrated, ONIOM molecular orbital method was applied to optimize the structure of all compounds while the DFT/B3LYP 6-31G(d) calculations were performed to examine molecular...

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Bibliographic Details
Main Authors: Siriporn Promsri, Parawan Chuichay, Vannajan Sanghiran, Vudhichai Parasuk, Supot Hannongbua
Format: Journal
Published: 2018
Subjects:
Biochemistry, Genetics and Molecular Biology
Chemistry
Physics and Astronomy
Online Access:https://www.scopus.com/inward/record.uri?partnerID=HzOxMe3b&scp=13944283878&origin=inward
http://cmuir.cmu.ac.th/jspui/handle/6653943832/62114
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Institution: Chiang Mai University

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https://www.scopus.com/inward/record.uri?partnerID=HzOxMe3b&scp=13944283878&origin=inward
http://cmuir.cmu.ac.th/jspui/handle/6653943832/62114

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