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RESEARCH PAPER · Journal of Computational Chemistry · 2024

Pre‐training strategy for antiviral drug screening with low‐data graph neural network: A case study in HIV ‐1 K103N reverse transcriptase

Kajjana Boonpalit, Hathaichanok Chuntakaruk, Jiramet Kinchagawat, Peter Wolschann, Supot V. Hannongbua, Thanyada Rungrotmongkol, Sarana Y. Nutanong

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Pre‐training strategy for antiviral drug screening with low‐data graph neural network: A case study in HIV ‐1 K103N reverse transcriptaseOriginalA general protocol for phosphorescent platinum(II) complexes: generation, high throughput virtual screening and highly accurate predictions4Artificial intelligence in human immunodeficiency virus mutation prediction and drug design: Advancing personalized treatment and prevention11Anti‐Symmetric Molecular Graph Learning Approach With Residual Adaptive Network Based Fuzzy Inference System for Lethal Dose Forecasting Problem1Can artificial intelligence transform antiviral drug discovery?5Cutting-edge developments in computer-aided anti-HIV drug design0

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  1. A general protocol for phosphorescent platinum(II) complexes: generation, high throughput virtual screening and highly accurate predictions

    Materials Futures · 2025-02-06

    Shuai Wang, ChiYung Yam, Lihong Hu, Faan‐Fung Hung, Shuguang Chen, Chi‐Ming Che, GuanHua Chen

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  2. Artificial intelligence in human immunodeficiency virus mutation prediction and drug design: Advancing personalized treatment and prevention

    Pharmaceutical Science Advances · 2025-06-26

    Karamot O. Oyediran, Peace Ofonabasi Bassey, Deborah A. Ogundemuren, Abdullahi Abdulraheem, Chukwuemeka Paul Azubuike, Andrew Nosakhare Amenaghawon, Margaret Okonawan Ilomuanya

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  3. Anti‐Symmetric Molecular Graph Learning Approach With Residual Adaptive Network Based Fuzzy Inference System for Lethal Dose Forecasting Problem

    Journal of Computational Chemistry · 2025-07-10

    Linh Nguyen Thi My, T N M Vo

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  4. Can artificial intelligence transform antiviral drug discovery?

    Drug Discovery Today · 2026-03-22

    Irina Tirosyan, Yeva Gabrielyan, Vahe Petrosyan, Marco Vignuzzi, Hovakim S. Zakaryan

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  5. Cutting-edge developments in computer-aided anti-HIV drug design

    Frontiers in Immunology · 2026-09-15

    Weiying Yang, Ye Wang, Chenda Feng, Wenjing Tang, Lichao Sun

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