Concepedia

Grace Gupta

GG

Statistics

Publications

15

Citations

397

H-Index

12

Active since

2021

Affiliations

Chapman University(Current)

Southern Methodist University

University of California San Diego

Grace Gupta is an author at Chapman University specializing in structural biology, molecular biology, and life sciences.

Publications per year

2021–2024

15

Publications

15

Comparative Perturbation-Based Modeling of the SARS-CoV-2 Spike Protein Binding with Host Receptor and Neutralizing Antibodies: Structurally Adaptable Allosteric Communication Hotspots Define Spike Sites Targeted by Global Circulating Mutations

Gennady M. Verkhivker, Steve Agajanian, Deniz Yazar Oztas et al. · Biochemistry · 2021 · 85 citations

Life Sciences, Bioinformatics, Molecular Biology +17

Dynamic Profiling of Binding and Allosteric Propensities of the SARS-CoV-2 Spike Protein with Different Classes of Antibodies: Mutational and Perturbation-Based Scanning Reveals the Allosteric Duality of Functionally Adaptable Hotspots

Gennady M. Verkhivker, Steve Agajanian, Deniz Yaşar Öztaş et al. · Journal of Chemical Theory and Computation · 2021 · 59 citations

Life Sciences, Biophysics, Molecular Biology +17

Markov State Models and Perturbation-Based Approaches Reveal Distinct Dynamic Signatures and Hidden Allosteric Pockets in the Emerging SARS-Cov-2 Spike Omicron Variant Complexes with the Host Receptor: The Interplay of Dynamics and Convergent Evolution Modulates Allostery and Functional Mechanisms

Sian Xiao, Mohammed Alshahrani, Grace Gupta et al. · Journal of Chemical Information and Modeling · 2023 · 43 citations · Full text

Life Sciences, Infectious Diseases, Molecular Biology +17

Allosteric Control of Structural Mimicry and Mutational Escape in the SARS-CoV-2 Spike Protein Complexes with the ACE2 Decoys and Miniprotein Inhibitors: A Network-Based Approach for Mutational Profiling of Binding and Signaling

Gennady M. Verkhivker, Steve Agajanian, Deniz Yaşar Öztaş et al. · Journal of Chemical Information and Modeling · 2021 · 30 citations

Life Sciences, Bioinformatics, Molecular Biology +17

AlphaFold2 Modeling and Molecular Dynamics Simulations of the Conformational Ensembles for the SARS-CoV-2 Spike Omicron JN.1, KP.2 and KP.3 Variants: Mutational Profiling of Binding Energetics Reveals Epistatic Drivers of the ACE2 Affinity and Escape Hotspots of Antibody Resistance

Nishank Raisinghani, Mohammed Alshahrani, Grace Gupta et al. · Viruses · 2024 · 28 citations · Full text

Life Sciences, Biology, Infectious Diseases +17

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