VUStruct: A compute pipeline for high throughput and personalized structural biology

• Christopher W. Moth,

  Roles Conceptualization, Data curation, Formal analysis, Investigation, Methodology, Project administration, Software, Supervision, Validation, Visualization, Writing – original draft, Writing – review & editing

  Affiliation Departments of Chemistry, Pharmacology, and Biomedical Informatics, Center for Structural Biology and Institute of Chemical Biology; Vanderbilt University, Nashville, Tennessee, United States of America

  https://orcid.org/0000-0001-8867-9369

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• Jonathan H. Sheehan,

  Roles Conceptualization, Data curation, Formal analysis, Investigation, Methodology, Project administration, Supervision, Validation, Visualization, Writing – original draft, Writing – review & editing

  Affiliation Division of Infectious Diseases, Department of Internal Medicine, Washington University School of Medicine, St. Louis, Missouri, United States of America

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• Abdullah Al Mamun,

  Roles Investigation, Methodology, Project administration, Supervision, Validation, Visualization, Writing – original draft, Writing – review & editing

  Affiliation Department of Biomedical Data Science, School of Applied Computational Sciences, Meharry Medical College, Nashville, Tennessee, United States of America

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• R. Michael Sivley,

  Roles Conceptualization, Data curation, Formal analysis, Investigation, Methodology, Software, Validation, Visualization

  Affiliation Biomedical Informatics at 5Prime Sciences, Montreal, Quebec, Canada

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• Alican Gulsevin,

  Roles Data curation, Formal analysis, Investigation, Methodology, Project administration, Software, Supervision, Validation, Visualization

  Affiliation Department of Pharmaceutical Sciences, College of Pharmacy and Health Sciences, Butler University, Indianapolis, Indiana, United States of America

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• David C. Rinker,

  Roles Investigation, Project administration, Supervision, Validation, Visualization

  Affiliation Department of Biological Sciences, Evolutionary Studies Initiative; Vanderbilt University, Nashville, Tennessee, United States of America

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• Zenab F. Mchaourab,

  Roles Investigation, Methodology, Validation, Visualization, Writing – review & editing

  Affiliation Meharry Medical College, Nashville, Tennessee, United States of America

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• Undiagnosed Diseases Network ,

  ¶Membership of the Undiagnosed Diseases Network is listed in the Acknowledgments.

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• John A. Capra,

  Roles Conceptualization, Funding acquisition, Project administration, Supervision, Writing – review & editing

  Affiliation Bakar Computational Health Science Institute and Department of Epidemiology and Biostatistics, University of California, San Francisco, California, United States of America

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• Jens Meiler

  Roles Conceptualization, Funding acquisition, Project administration, Supervision, Writing – review & editing

  * E-mail: jens.meiler@vanderbilt.edu

  Affiliations Departments of Chemistry, Pharmacology, and Biomedical Informatics, Center for Structural Biology and Institute of Chemical Biology; Vanderbilt University, Nashville, Tennessee, United States of America, Leipzig University Medical School, Institute for Drug Discovery, Leipzig, Germany

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