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Computational Drug Discovery Methods

Работ: 186

  1. Deep Learning for Predicting Drug-Drug Interactions and Patient Safety in Dental Clinical Trials

    Niladri Maiti, Riddhi Chawla, Babacar Toure +2

    СтатьяMachine Learning in Healthcare2025Цитирований: 0
    ABI

  2. AI-Driven Drug Discovery: Accelerating the Path to New Therapies

    Khamza Khamrayev

    СтатьяArtificial Intelligence in Healthcare and Education2025Цитирований: 0
    ABI

  3. Large Language Models-guided Agentic Discovery of Imaging-informed Pharmacodynamic Models for Predicting Hematological Toxicity from Radioligand Therapy

    Romain Ferrara, Victor Gertner, Adil Moussali +7

    ПрепринтComputational Drug Discovery MethodsHAL (Le Centre pour la Communication Scientifique Directe)2025Цитирований: 0
    ABI

  4. Synergism or mirage: Current progress and an empirical approach for elucidating combination drug effects

    Paola Vottero, Jack A. Tuszyński, Yun K. Tam +1

    Обзорная статьяComputational Drug Discovery MethodsDrug Discovery Today2025Цитирований: 0
    ABI

  5. Acalypha indica: A comprehensive review of its natural compounds, and traditional medicine applications in COVID-19 management

    Soumya Ghosh, Jovana Vunduk, Norfaizah Mahmud +8

    Обзорная статьяDrug-Induced Hepatotoxicity and ProtectionPharmacological Research - Natural Products2025Цитирований: 0
    ABI

  6. Regression-based analysis of topological indices in simple molecular graphs of anti-HIV drug compounds

    Yasir Bashir, Bilal A. Chat, Bilal Ahmad Rather

    СтатьяGraph theory and applicationsThe Journal of Supercomputing2026Цитирований: 0
    ABI

  7. Artificial intelligence predictive models in nanoparticle analysis for cancer targeted therapy: A systematic review

    Sara Rahmani, Solmaz Sohrabei, Elham Nazari +4

    СтатьяComputational Drug Discovery MethodsNano TransMed2026Цитирований: 0
    ABI

  8. Deciphering enzyme inhibition of thiazole assemblies for diabetes management via molecular docking, dynamic simulation, DFT and kinetic study: A computational therapeutic strategy

    Uthman Alghamdi, Shoaib Khan, Tayyiaba Iqbal +6

    СтатьяComputational Drug Discovery MethodsComputational Biology and Chemistry2026Цитирований: 0
    ABI

  9. Prediction of gas chromatographic retention times of narcotic and hazardous drugs in blood using QSRR and machine learning models

    Mohamed Abu Shuheil, Ahmed Aldulaimi, Subhashree Ray +6

    СтатьяComputational Drug Discovery MethodsRSC Advances2026Цитирований: 0
    ABI

  10. Predicting Side Effects of Drug Reactions Using Machine Learning and Graph Neural Network

    V. Rekha, B. Syed Moinuddin Bokhari, Erkin Kholiyarov +4

    СтатьяPharmacovigilance and Adverse Drug Reactions2026Цитирований: 0
    ABI

  11. Repurposing Existing Drugs For Dual Treatment of Alzheimer'S Disease and Type 2 Diabetes Mellitus: A Network Pharmacology Approach

    ASKAROV Ibragim Rakhmanovich, Mahliyo Anvarova Ma'rufjon qizi, Khamroeva Lola Rizoyevna +3

    СтатьяNatural Antidiabetic Agents StudiesInternational Journal of Drug Delivery Technology2026Цитирований: 0
    ABI