In silico evaluation of the inhibitory potential of nucleocapsid inhibitors of SARS-CoV-2: a binding and energetic perspective

Haque, Shafiul; Kumar, Pawan; Mathkor, Darin Mansor; Bantun, Farkad; Jalal, Naif A.; Mufti, Ahmad H.; Prakash, Amresh; Kumar, Vijay

doi:10.1080/07391102.2022.2146752

Journal of Biomolecular Structure and Dynamics

2022

DOI: 10.1080/07391102.2022.2146752

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In silico evaluation of the inhibitory potential of nucleocapsid inhibitors of SARS-CoV-2: a binding and energetic perspective

Shafiul Haque

Pawan Kumar

Darin Mansor Mathkor

et al.

Abstract: 6M3M). Minimally frustrated and highly frustrated interactions are shown in green and red, respectively. At right, a quantification of the residual frustration is displayed.

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In silico evaluation of the inhibitory potential of nucleocapsid inhibitors of SARS-CoV-2: a binding and energetic perspective

Abstract: 6M3M). Minimally frustrated and highly frustrated interactions are shown in green and red, respectively. At right, a quantification of the residual frustration is displayed.

Cited by 1 publication

References 70 publications

Energetic and frustration analysis of SARS-CoV-2 nucleocapsid protein mutations

Energetic and frustration analysis of SARS-CoV-2 nucleocapsid protein mutations

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