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Florbela Pereira

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    12 09 2019
    < 1 minute

    A Ligand-Based Approach to the Discovery of Lead-Like Potassium Channel KV1.3 Inhibitors

    Voltage-gated ion channels are key molecular targets for autoimmune diseases such as multiple...

    12 09 2019
    < 1 minute

    Machine learning for the prediction of molecular dipole moments obtained by density functional theory

    Machine learning (ML) algorithms were explored for the fast estimation of molecular dipole moments...

    12 09 2019
    < 1 minute

    In Silico HCT116 Human Colon Cancer Cell-Based Models En Route to the Discovery of Lead-Like Anticancer Drugs

    To discover new inhibitors against the human colon carcinoma HCT116 cell line, two quantitative...

    12 09 2019
    < 1 minute

    A Computer-Driven Approach to Discover Natural Product Leads for Methicillin-Resistant Staphylococcus aureus Infection Therapy

    The risk of methicillin-resistant Staphylococcus aureus (MRSA) infection is increasing in both the...