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SBQT 2021

ISSN: 2965-5900
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Anais do Simpósio Brasileiro de Química Teórica
Proceedings of the XXI Brazilian Symposium on Theoretical Chemistry - Vol. 1 2021

ISSN: 2965-5900
  • English
  • Portuguese, Brazil
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Universidade Federal de Goiás

Carolina Andrade

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Papers 1
  • Dock2ONIOM: Utilitário Python para Rescoring de Poses de Docking Molecular pelo Método ONIOM

    • Leonardo Viana das Chagas Lima 1
    • Melina Mottin 2
    • Carolina Andrade 3
    • nhmorgon 1
    • 1 Universidade Estadual de Campinas
    • 2 Laboratory of Molecular Modeling and Drug Design (LabMol) / Faculty of Pharmacy / Federal University of Goiás
    • 3 Universidade Federal de Goiás
    Vol 21, 2021 -
    141783
    Computational Chemistry
    Apresentação de Pôster / Poster Communications

Co-authors (3)

  • nhmorgon

    9 publications

  • Leonardo Viana das Chagas Lima

    1 publication

  • Melina Mottin

    1 publication

Publications in other proceedings

  • SBBf 2023

    Artificial intelligence-driven hit identification for neglected tropical diseases

  • BrazMedChem 2022

    Multitask Learning Approach to Predict Hepatotoxicity Phenotypes of Chemicals in Clinical Assays

  • BrazMedChem 2022

    Cheminformatics-driven identification of new antiplasmodial hits effective against asexual and sexual stages

  • BrazMedChem 2022

    Search for inhibitors for the human Dihydroorotate Dehydrogenase as a contemporary approach for the fight against COVID-19 disease.

  • BrazMedChem 2022

    Computational approaches for the discovery of new inhibitors of human dihydroorotate dehydrogenase as drug candidates for the treatment of COVID-19

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