Nishank Raisinghani, Mohammed Alshahrani, Grace Gupta, Sian Xiao, Peng Tao 0001, Gennady Verkhivker. AlphaFold2-Enabled Atomistic Modeling of Structure, Conformational Ensembles, and Binding Energetics of the SARS-CoV-2 Omicron BA.2.86 Spike Protein with ACE2 Host Receptor and Antibodies: Compensatory Functional Effects of Binding Hotspots in Modulating Mechanisms of Receptor Binding and Immune Escape. Journal of Chemical Information and Computer Sciences, 64(5):1657-1681, March 2024. [doi]
@article{RaisinghaniAGXTV24, title = {AlphaFold2-Enabled Atomistic Modeling of Structure, Conformational Ensembles, and Binding Energetics of the SARS-CoV-2 Omicron BA.2.86 Spike Protein with ACE2 Host Receptor and Antibodies: Compensatory Functional Effects of Binding Hotspots in Modulating Mechanisms of Receptor Binding and Immune Escape}, author = {Nishank Raisinghani and Mohammed Alshahrani and Grace Gupta and Sian Xiao and Peng Tao 0001 and Gennady Verkhivker}, year = {2024}, month = {March}, doi = {10.1021/acs.jcim.3c01857}, url = {https://doi.org/10.1021/acs.jcim.3c01857}, researchr = {https://researchr.org/publication/RaisinghaniAGXTV24}, cites = {0}, citedby = {0}, journal = {Journal of Chemical Information and Computer Sciences}, volume = {64}, number = {5}, pages = {1657-1681}, }