Representability of algebraic topology for biomolecules in machine learning based scoring and virtual screening

• Zixuan Cang,

  Roles Conceptualization, Data curation, Funding acquisition, Investigation, Methodology, Project administration, Software, Validation, Visualization, Writing – original draft, Writing – review & editing

  Affiliation Department of Mathematics, Michigan State University, East Lansing, Michigan, United States of America

  http://orcid.org/0000-0002-9951-5586

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• Lin Mu,

  Roles Data curation, Investigation, Validation, Writing – review & editing

  Affiliation Computer Science and Mathematics Division, Oak Ridge National Laboratory, Oak Ridge, Tennessee, United States of America

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• Guo-Wei Wei

  Roles Conceptualization, Funding acquisition, Investigation, Methodology, Project administration, Resources, Supervision, Visualization, Writing – original draft, Writing – review & editing

  * E-mail: wei@math.msu.edu

  Affiliations Department of Mathematics, Michigan State University, East Lansing, Michigan, United States of America, Department of Biochemistry and Molecular Biology, Michigan State University, East Lansing, Michigan, United States of America, Department of Electrical and Computer Engineering, Michigan State University, East Lansing, Michigan, United States of America

  http://orcid.org/0000-0001-8132-5998

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