Design of peptide-based PAC1 antagonists combining molecular dynamics simulations and a biologically relevant cell-based assay.

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Bibliographic Details
Title: Design of peptide-based PAC1 antagonists combining molecular dynamics simulations and a biologically relevant cell-based assay.
Authors: Xu W; Section on Molecular Neuroscience, NIMH-IRP, Bethesda, Maryland, USA., Keith AM; Section on Molecular Neuroscience, NIMH-IRP, Bethesda, Maryland, USA., Ye W; Early Translation Branch, National Center for Advancing Translational Sciences, National Institutes of Health, Rockville, Maryland, USA., Hu X; Early Translation Branch, National Center for Advancing Translational Sciences, National Institutes of Health, Rockville, Maryland, USA., Southall N; Early Translation Branch, National Center for Advancing Translational Sciences, National Institutes of Health, Rockville, Maryland, USA., Marugan JJ; Early Translation Branch, National Center for Advancing Translational Sciences, National Institutes of Health, Rockville, Maryland, USA., Ferrer M; Early Translation Branch, National Center for Advancing Translational Sciences, National Institutes of Health, Rockville, Maryland, USA., Henderson MJ; Early Translation Branch, National Center for Advancing Translational Sciences, National Institutes of Health, Rockville, Maryland, USA., Sexton PM; Drug Discovery Biology theme and ARC Centre for Cryo-electron Microscopy of Membrane Proteins, Monash Institute of Pharmaceutical Sciences, Monash University, Parkville, Victoria, Australia., Deganutti G; Centre for Health and Life Sciences, Coventry University, Coventry, UK., Eiden LE; Section on Molecular Neuroscience, NIMH-IRP, Bethesda, Maryland, USA.
Source: BioRxiv : the preprint server for biology [bioRxiv] 2025 May 09. Date of Electronic Publication: 2025 May 09.
Publication Type: Journal Article; Preprint
Journal Info: Country of Publication: United States NLM ID: 101680187 Publication Model: Electronic Cited Medium: Internet ISSN: 2692-8205 (Electronic) Linking ISSN: 26928205 NLM ISO Abbreviation: bioRxiv Subsets: PubMed not MEDLINE
Database: MEDLINE Ultimate
Description
ISSN:2692-8205
DOI:10.1101/2025.04.16.649181