Simulation-driven design of stabilized SARS-CoV-2 spike S2 immunogens
Nuqui, Xandra, Casalino, Lorenzo, Zhou, Ling, Shehata, Mohamed, Wang, Albert, Tse, Alexandra L., Ojha, Anupam A., Kearns, Fiona L., Rosenfeld, Mia A., Miller, Emily Happy, Acreman, Cory M., Ahn, Surl-Hee, Chandran, Kartik, McLellan, Jason S., Amaro, Rommie E.
Published in Nature communications (27.08.2024)
Published in Nature communications (27.08.2024)
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Molecular Properties of Drugs Handled by Kidney OATs and Liver OATPs Revealed by Chemoinformatics and Machine Learning: Implications for Kidney and Liver Disease
Nigam, Anisha K, Ojha, Anupam A, Li, Julia G, Shi, Da, Bhatnagar, Vibha, Nigam, Kabir B, Abagyan, Ruben, Nigam, Sanjay K
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Published in Journal of chemical theory and computation (14.12.2021)
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Stabilized SARS-CoV-2 spike S2 immunogens designed using insights from enhanced sampling molecular dynamics simulations
Nuqui, Xandra, Casalino, Lorenzo, Shehata, Mohamed, Ojha, Anupam A., Kearns, Fiona L., Rosenfeld, Mia, McLellan, Jason S., Amaro, Rommie E.
Published in Biophysical journal (10.02.2023)
Published in Biophysical journal (10.02.2023)
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Harnessing molecular simulations to design stabilized SARS-CoV-2 S2 antigens
Casalino, Lorenzo, Nuqui, Xandra, Zhou, Ling, Shehata, Mohamed, Wang, Albert, Tse, Alexandra L., Ojha, Anupam A., Kearns, Fiona L., Rosenfeld, Mia A., Miller, Emily H., Acreman, Cory M., Ahn, Surl-Hee, Chandran, Kartik, McLellan, Jason S., Amaro, Rommie E.
Published in Biophysical journal (08.02.2024)
Published in Biophysical journal (08.02.2024)
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