Rapid prediction of crucial hotspot interactions for icosahedral viral capsid self-assembly by energy landscape atlasing validated by mutagenesis

• Ruijin Wu,

  Roles Data curation, Methodology, Software, Writing – original draft

  Affiliation Department of Computer and Information Science and Engineering, University of Florida, Gainesville, Florida, United States of America

  https://orcid.org/0000-0001-7309-3584

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• Rahul Prabhu,

  Roles Methodology, Software, Writing – original draft, Writing – review & editing

  Affiliation Department of Computer and Information Science and Engineering, University of Florida, Gainesville, Florida, United States of America

  https://orcid.org/0000-0003-4481-2230

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• Aysegul Ozkan,

  Roles Software

  Affiliation Department of Computer and Information Science and Engineering, University of Florida, Gainesville, Florida, United States of America

  https://orcid.org/0000-0003-4331-3771

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• Meera Sitharam

  Roles Conceptualization, Formal analysis, Funding acquisition, Investigation, Project administration, Writing – original draft, Writing – review & editing

  * E-mail: sitharam@cise.ufl.edu

  Affiliation Department of Computer and Information Science and Engineering, University of Florida, Gainesville, Florida, United States of America

  https://orcid.org/0000-0003-1031-1403

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