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SAR and QSAR in Environmental Research Volume 17, 2006 - Issue 2: Computational Methods in Toxicology and Pharmacology Integrating Internet Resources, (CMTPI 2005)–Part 2, Shanghai, China, October 29–November 1, 2005, Guest Editors: B. T. Fan, B. Jiang, J. P. Doucet and J. H. Yao
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Original Articles

Design of nevirapine derivatives insensitive to the K103N and Y181C HIV-1 reverse transcriptase mutants

P. Saparpakorn Department of Chemistry, Faculty of Science, Kasetsart University, Bangkok, 10900, Thailand
,
S. Hannongbua Department of Chemistry, Faculty of Science, Kasetsart University, Bangkok, 10900, ThailandCorrespondence[email protected]
&
D. Rognan Laboratoire de Pharmacochimie de la Communication Cellulaire, UMR CNRS 7081, F-67401 Illkirch, France
Pages 183-194 | Received 01 Nov 2005, Accepted 10 Jan 2006, Published online: 01 Feb 2007

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Hina Shamshad, Maria Saeed, Zaheer Ul-Haq, Sobia Ahsan Halim, Sana Gul & Agha Zeeshan Mirza. (2022) Relative assessment of different statistical instruments and measures for the prediction of promising outcomes using docking, virtual screening and ADMET analysis against HIV-RT. Journal of Biomolecular Structure and Dynamics 40:17, pages 7680-7692.
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Articles from other publishers (3)

Patchreenart Saparpakorn, Peter Wolschann, Alfred Karpfen, Pornpan Pungpo & Supa Hannongbua. (2011) Systematic investigation on the binding of GW420867X as HIV-1 reverse transcriptase inhibitor. Monatshefte für Chemie - Chemical Monthly 142:9, pages 961-971.
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Witcha Treesuwan & Supa Hannongbua. (2009) Bridge water mediates nevirapine binding to wild type and Y181C HIV-1 reverse transcriptase—Evidence from molecular dynamics simulations and MM-PBSA calculations. Journal of Molecular Graphics and Modelling 27:8, pages 921-929.
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Veeramol Vailikhit, Witcha Treesuwan & Supa Hannongbua. (2007) A combined MD–ONIOM2 approach for 1H NMR chemical shift calculations including a polar solvent. Journal of Molecular Structure: THEOCHEM 806:1-3, pages 99-104.
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