Figure 2

Sites and Zones of Maximum Reactivity of the most Stable Structure of the Receptor-binding Domain of Wild-type SARS-CoV-2 Spike Protein: A Quantum Density Functional Theory Study

Ernesto López-Chávez*, Alberto García-Quiroz, Yesica Antonia Peña-Castañeda, José Antonio Irán Díaz-Góngora, José Alberto Mendoza-Espinoza, Jose Antonio López-Barrera and Fray de Landa Castillo-Alvarado

Published: 12 April, 2024 | Volume 9 - Issue 1 | Pages: 008-016

jcicm-aid1047-g002

Figure 2:

The green lobes represent the spatial distribution of the proper function of the HOMO frontier molecular orbital. The O(528) oxygen atom has the maximum Fukui index value.

Read Full Article HTML DOI: 10.29328/journal.jcicm.1001047 Cite this Article Read Full Article PDF

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