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SBQT 2023

ISSN: 2965-5900
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Anais do Simpósio Brasileiro de Química Teórica
Proceedings of the XXII Brazilian Symposium on Theoretical Chemistry - Vol. 2 2023

ISSN: 2965-5900
  • English
  • Portuguese, Brazil
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Instituto de Física (IFUSP)

PEDRO TENDRIH SODRE

Also published on: SBQT 2021

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Papers 1
  • Proline containing lipopeptide modelling with Hybrid Particle-field: From parameter optimization to investigating experimental data

    • SODRÉ, Pedro 1
    • CARRER, Manuel 2
    • CEZAR, Henrique Musseli 2
    • CASCELLA, Michele 2
    • COUTINHO-NETO, Mauricio D. 1
    • 1 Universidade Federal do ABC
    • 2 Hylleraas Centre for Quantum Molecular Sciences / Department of Chemistry / University of Oslo
    Vol 2, 2023 -
    164223
    Molecular Dynamics
    Pôster / Poster

Co-authors (4)

  • Mauricio D. Coutinho-Neto

    2 publications

  • Manuel Carrer

    1 publication

  • Henrique Musseli Cezar

    1 publication

  • Michele Cascella

    1 publication

Publications in other proceedings

  • SBBf-2025

    SEARCHING CONFORMATIONS FOR THE AMYLIN PEPTIDE: REPLICA EXCHANGE SIMULATIONS AND COMPARISON WITH THE EXPERIMENT

  • SBBf-2025

    ELUCIDATING AMYLIN PEPTIDE STRUCTURAL PROPERTIES BY EXPERIMENTAL TECHNIQUES AND MD SIMULATIONS

  • SBBf-2024

    THE PRWGC18 AS A BIOCATALYST OF THE ALDOL REACTION: INVESTIGATING THE SELECTIVITY BY COMBINING QUANTUM AND CLASSICAL METHODS

  • SBBf 2023

    Proline containing lipopeptides aggregates as weak acids: Insights from Constant pH molecular dynamics

  • SBQT 2021

    Elucidação teórica da enantiosseletividade de lipopeptídeos contendo L-Prolina

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