Role of simple descriptors and applicability domain in predicting change in protein thermostability

• Kenneth N. McGuinness,

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

  Current address: Department of Biochemistry and Microbiology, Rutgers University, New Brunswick, New Jersey, United States America

  Affiliation Modeling and Informatics, Merck & Co., Inc., Kenilworth, New Jersey, United States of America

  http://orcid.org/0000-0003-1898-1575

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• Weilan Pan,

  Roles Data curation, Investigation, Validation

  Affiliation Biochemical Engineering and Structure, Merck & Co., Inc., Rahway, New Jersey, United States of America

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• Robert P. Sheridan,

  Roles Formal analysis, Investigation, Resources, Software, Supervision, Writing – review & editing

  Affiliation Modeling and Informatics, Merck & Co., Inc., Kenilworth, New Jersey, United States of America

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• Grant Murphy,

  Roles Conceptualization, Data curation, Supervision, Writing – original draft

  Affiliation Biochemical Engineering and Structure, Merck & Co., Inc., Rahway, New Jersey, United States of America

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• Alejandro Crespo

  Roles Conceptualization, Data curation, Formal analysis, Investigation, Project administration, Supervision, Writing – review & editing

  * E-mail: alejandro.crespo@emdserono.com

  Current address: Drug Structure, Prediction, and Design, EMD Serono Research and Development Institute, Inc., Billerica, Massachusetts, United States America

  Affiliation Modeling and Informatics, Merck & Co., Inc., Kenilworth, New Jersey, United States of America

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