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Molecular interactions of the Omicron, Kappa, and Delta SARS-CoV-2 spike proteins with quantum dots of graphene oxide.

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第一作者： Tiago,da Silva Arouche

第一单位： Laboratory of Preparation and Computing of Nanomaterials (LPCN), Federal University of Pará, C. P. 479, Belém, PA, 66075-110, Brazil.

作者： Tiago,da Silva Arouche ^[1] ; Julio Cesar Mendes,Lobato ^[2] ; Rosivaldo,Dos Santos Borges ^[3] ; Mozaniel Santana,de Oliveira ^[4] ; Antonio Maia,de Jesus Chaves Neto ^[5]

作者单位： Laboratory of Preparation and Computing of Nanomaterials (LPCN), Federal University of Pará, C. P. 479, Belém, PA, 66075-110, Brazil. ^[1] Laboratory of Preparation and Computing of Nanomaterials (LPCN), Federal University of Pará, C. P. 479, Belém, PA, 66075-110, Brazil.;Graduate Program in Natural Resources Engineering of the Amazon, ITEC, Federal University of Pará, C. P. 2626, Belém, PA, 66050-540, Brazil. ^[2] Universidade Federal do Pará, Departamento de Farmácia/Laboratório de Química Farmacêutica, Belem, PA, 66075-110, Brazil. ^[3] Museu Paraense Emílio Goeldi. Av. Gov Magalhães Barata, 376 - São Braz, Belém, PA, 66040-170, Brazil. ^[4] Laboratory of Preparation and Computing of Nanomaterials (LPCN), Federal University of Pará, C. P. 479, Belém, PA, 66075-110, Brazil. amchaves@ufpa.br.;Graduate Program in Natural Resources Engineering of the Amazon, ITEC, Federal University of Pará, C. P. 2626, Belém, PA, 66050-540, Brazil. amchaves@ufpa.br.;Graduate Program in Chemical Engineering, ITEC, Federal University of Pará, C. P. 479, Belém, PA, 66075-900, Brazil. amchaves@ufpa.br.;Mestrado Nacional Profissional em Ensino de Física, Federal University of Pará, C. P.479, Belém, PA, 66075-110, Brazil. amchaves@ufpa.br. ^[5]

关键词 COVID-19 Molecular docking Molecular dynamics Quantum dots SARS-CoV-2

主题词石墨(Graphite);量子点(Quantum Dots);分子动力学模拟(Molecular Dynamics Simulation);人类(Humans);蛋白质结合(Protein Binding);静电(Static Electricity)

DOI 10.1007/s00894-024-05996-z

PMID 38858279

发布时间 2024-07-05

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