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The Journal of Physical Chemistry. B|December 5, 2008
Quantum mechanical study of photoinduced charge transfer in FMN binding proteinNadtanet Nunthaboot, Fumio Tanaka, Sirirat Kokpol, et al.Computational Biology and Chemistry|February 8, 2018
Physical quantity of residue electrostatic energy in flavin mononucleotide binding protein dimerNadtanet Nunthaboot, Arthit Nueangaudom, Kiattisak Lugsanangarm, et al.Journal of Molecular Graphics & Modelling|April 3, 2026
Molecular encapsulation of hydroxychloroquine by cucurbit[n]urils: A combined molecular dynamics simulation and quantum chemical studyNadtanet Nunthaboot, Paweena Wongngam, Chananya Rajchakom, et al.Computational Biology and Chemistry|June 22, 2016
Conformational difference between two subunits in flavin mononucleotide binding protein dimers from Desulfovibrio vulgaris (MF): molecular dynamics simulationNadtanet Nunthaboot, Kiattisak Lugsanangarm, Somsak Pianwanit, et al.Biophysical Journal|August 19, 2007
Hybrid quantum mechanical/molecular mechanical molecular dynamics simulations of HIV-1 integrase/inhibitor complexesNadtanet Nunthaboot, Somsak Pianwanit, Vudhichai Parasuk, et al.Biophysical Chemistry|September 8, 2009
How does each substituent functional group of oseltamivir lose its activity against virulent H5N1 influenza mutants?Thanyada Rungrotmongkol, Thanyarat Udommaneethanakit, Maturos Malaisree, et al.Journal of Molecular Graphics & Modelling|November 2, 2010
Molecular insight into the specific binding of ADP-ribose to the nsP3 macro domains of chikungunya and Venezuelan equine encephalitis viruses: molecular dynamics simulations and free energy calculationsThanyada Rungrotmongkol, Nadtanet Nunthaboot, Maturos Malaisree, et al.Journal of Enzyme Inhibition and Medicinal Chemistry|June 30, 2010
Evaluating how rimantadines control the proton gating of the influenza A M2-proton port via allosteric binding outside of the M2-channel: MD simulationsPathumwadee Intharathep, Thanyada Rungrotmongkol, Panita Decha, et al.Proteins|July 4, 2017
Dynamics of the protein structure of T169S pyranose 2-oxidase in solution: Molecular dynamics simulationKiattisak Lugsanangarm, Arthit Nueangaudom, Somsak Pianwanit, et al.Amino Acids|November 13, 2008
Source of oseltamivir resistance in avian influenza H5N1 virus with the H274Y mutationMaturos Malaisree, Thanyada Rungrotmongkol, Nadtanet Nunthaboot, et al.Pageof 4