Fragment-based design of small molecule PCSK9 inhibitors using simulated annealing of chemical potential simulations

• Frank Guarnieri ,

  Roles Conceptualization, Formal analysis, Methodology, Project administration, Supervision, Writing – original draft

  * E-mail: frankguarnieri@yahoo.com

  Affiliations Center for Drug Discovery, Northeastern University, Boston, MA, United States of America, PAKA Pulmonary Pharmaceuticals, Acton, MA, United States of America

  http://orcid.org/0000-0003-0482-3509

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• John L. Kulp Jr.,

  Roles Data curation, Funding acquisition, Software, Validation, Visualization

  Affiliation Conifer Point Pharmaceuticals, Doylestown, PA, United States of America

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• John L. Kulp III,

  Roles Data curation, Resources, Validation, Visualization

  Affiliations Conifer Point Pharmaceuticals, Doylestown, PA, United States of America, Department of Chemistry, Baruch S. Blumberg Institute, Doylestown, PA, United States of America

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• Ian S. Cloudsdale

  Roles Data curation, Resources, Validation

  Affiliation Conifer Point Pharmaceuticals, Doylestown, PA, United States of America

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