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Supa Hannongbua
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2020 – today
- 2024
- [j19]Bongkochawan Pakamwong
, Paptawan Thongdee
Ligand-Based Virtual Screening for Discovery of Indole Derivatives as Potent DNA Gyrase ATPase Inhibitors Active against Mycobacterium tuberculosis and Hit Validation by Biological Assays. J. Chem. Inf. Model. 64(15): 5991-6002 (2024) - 2023
- [j18]Bundit Kamsri
Bioisosteric Design Identifies Inhibitors of Mycobacterium tuberculosis DNA Gyrase ATPase Activity. J. Chem. Inf. Model. 63(9): 2707-2718 (2023) - 2022
- [j17]Bongkochawan Pakamwong
Identification of Potent DNA Gyrase Inhibitors Active against Mycobacterium tuberculosis. J. Chem. Inf. Model. 62(7): 1680-1690 (2022) - [j16]Paptawan Thongdee
Virtual Screening Identifies Novel and Potent Inhibitors of Mycobacterium tuberculosis PknB with Antibacterial Activity. J. Chem. Inf. Model. 62(24): 6508-6518 (2022) - 2020
- [j15]Pharit Kamsri
Discovery of New and Potent InhA Inhibitors as Antituberculosis Agents: Structure-Based Virtual Screening Validated by Biological Assays and X-ray Crystallography. J. Chem. Inf. Model. 60(1): 226-234 (2020)
2010 – 2019
- 2019
- [j14]Manaschai Kunaseth
Shift/collapse on neighbor list (SC-NBL): Fast evaluation of dynamic many-body potentials in molecular dynamics simulations. Comput. Phys. Commun. 235: 88-94 (2019) - [j13]Auradee Punkvang
Simulations of Shikimate Dehydrogenase from Mycobacterium tuberculosis in Complex with 3-Dehydroshikimate and NADPH Suggest Strategies for MtbSDH Inhibition. J. Chem. Inf. Model. 59(4): 1422-1433 (2019) - 2016
- [j12]Patcharapong Thangsunan
Rapid activity prediction of HIV-1 integrase inhibitors: harnessing docking energetic components for empirical scoring by chemometric and artificial neural network approaches. J. Comput. Aided Mol. Des. 30(6): 471-488 (2016) - 2010
- [j11]Rungtiwa Chidthong, Supa Hannongbua
Excited state properties, fluorescence energies, and lifetimes of a poly(fluorene-phenylene), based on TD-DFT investigation. J. Comput. Chem. 31(7): 1450-1457 (2010) - [j10]Potjaman Poolmee, Supa Hannongbua
Investigation of excited-state properties of fluorene-thiophene oligomers by the SAC-CI theoretical approach. J. Comput. Chem. 31(10): 1945-1955 (2010)
2000 – 2009
- 2009
- [j9]Phornphimon Maitarad, Sumalee Kamchonwongpaisan
Interactions between cycloguanil derivatives and wild type and resistance-associated mutant Plasmodium falciparum dihydrofolate reductases. J. Comput. Aided Mol. Des. 23(4): 241-252 (2009) - [j8]Poonsiri Thipnate, Jianzhong Liu, Supa Hannongbua
3D Pharmacophore Mapping Using 4D QSAR Analysis for the Cytotoxicity of Lamellarins Against Human Hormone-Dependent T47D Breast Cancer Cells. J. Chem. Inf. Model. 49(10): 2312-2322 (2009) - 2007
- [j7]Rungtiwa Chidthong, Supa Hannongbua
Excited state properties, fluorescence energies, and lifetime of a poly(fluorene-pyridine) copolymer, based on TD-DFT investigation. J. Comput. Chem. 28(10): 1735-1742 (2007) - 2003
- [j6]Suwipa Saen-oon
Structural Flexibility of Non-Nucleoside HIV-1 Reverse Transcriptase Inhibitor: 9-Cl TIBO as Explained by Potential Energy Surface and 13C and 1H NMR Calculations, Based on ab initio and Density Functional Study. J. Chem. Inf. Comput. Sci. 43(5): 1412-1422 (2003) - [j5]Mayuso Kuno, Rungtiva Palangsuntikul
Investigation on an Orientation and Interaction Energy of the Water Molecule in the HIV-1 Reverse Transcriptase Active Site by Quantum Chemical Calculations. J. Chem. Inf. Comput. Sci. 43(5): 1584-1590 (2003) - 2001
- [j4]Supa Hannongbua
Conformational analysis of nevirapine, a non-nucleoside HIV-1 reverse transcriptase inhibitor, based on quantum mechanical calculations. J. Comput. Aided Mol. Des. 15(11): 997-1004 (2001) - [j3]Supa Hannongbua
3D-Quantitative Structure-Activity Relationships of HEPT Derivatives as HIV-1 Reverse Transcriptase Inhibitors, Based on Ab Initio Calculations. J. Chem. Inf. Comput. Sci. 41(3): 848-855 (2001)
1990 – 1999
- 1999
- [j2]Supa Hannongbua
Quantitative structure-activity relationships and comparative molecular field analysis of TIBO derivatised HIV-1 reverse transcriptase inhibitors. J. Comput. Aided Mol. Des. 13(6): 563-577 (1999) - 1996
- [j1]Supa Hannongbua, Luckhana Lawtrakul
Structure-activity correlation study of HIV-1 inhibitors: Electronic and molecular parameters. J. Comput. Aided Mol. Des. 10(2): 145-152 (1996)
Coauthor Index
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