The structural evaluation of lithium chloride in liquid hydroxylamine by monte carlo simulation

by Pornthep Sompornpisut
Published 2013

Molecular dynamics simulation of the human apo-dihydrofolate reductase: An investigation of an unstable enzyme

by Pornthep Sompornpisut, Atchara Wijitkosoom, Vudhichai Parasuk, Worachart Sirawaraporn
Published 2018

Structural and dynamical properties of different protonated states of mutant HIV-1 protease complexed with the saquinavir inhibitor studied by molecular dynamics simulations

by Ornjira Aruksakunwong, Kitiyaporn Wittayanarakul, Pornthep Sompornpisut, Vannajan Sanghiran, Vudthichai Parasuk, Supot Hannongbua
Published 2018

Structural analysis of lead fullerene-based inhibitor bound to human immunodeficiency virus type 1 protease in solution from molecular dynamics simulations

by Vannajan S. Lee, Piyarat Nimmanpipug, Ornjira Aruksakunwong, Siriporn Promsri, Pornthep Sompornpisut, Supot Hannongbua
Published 2018

How does each substituent functional group of oseltamivir lose its activity against virulent H5N1 influenza mutants?

by Thanyada Rungrotmongkol, Thanyarat Udommaneethanakit, Maturos Malaisree, Nadtanet Nunthaboot, Pathumwadee Intharathep, Pornthep Sompornpisut, Supot Hannongbua
Published 2018

Structure, dynamics and solvation of HIV-1 protease/saquinavir complex in aqueous solution and their contributions to drug resistance: Molecular dynamic simulations

by Kitiyaporn Wittayanarakul, Ornjira Aruksakunwong, Pornthep Sompornpisut, Vannajan Sanghiran-Lee, Vudhichai Parasuk, Surapong Pinitglang, Supot Hannongbua
Published 2018

Insights into saquinavir resistance in the G48V HIV-1 protease: Quantum calculations and molecular dynamic simulations

by Kitiyaporn Wittayanarakul, Ornjira Aruksakunwong, Suwipa Saen-Oon, Wasun Chantratita, Vudhichai Parasuk, Pornthep Sompornpisut, Supot Hannongbua
Published 2018

Current development on HIV-1 protease inhibitors

by Ornjira Arusksakunwong, Siriporn Promsri, Kitiyaporn Wittayanarakul, Piyarat Nimmanpipug, Vannajan S. Lee, Atchara Wijitkosoom, Pornthep Sompornpisut, Supot Hannongbua
Published 2018

Why amantadine loses its function in influenza M2 mutants: MD simulations

by Chittima Laohpongspaisan, Thanyada Rungrotmongkol, Pathumwadee Intharathep, Maturos Malaisree, Panita Decha, Ornjira Aruksakunwong, Pornthep Sompornpisut, Supot Hannongbua
Published 2018

Evaluating how rimantadines control the proton gating of the influenza A M2-proton port via allosteric binding outside of the M2-channel: MD simulations

by Pathumwadee Intharathep, Thanyada Rungrotmongkol, Panita Decha, Nadtanet Nunthaboot, Nopphorn Kaiyawet, Teerakiat Kerdcharoen, Pornthep Sompornpisut, Supot Hannongbua
Published 2018

Interaction of pyrimethamine, cycloguanil, WR99210 and their analogues with Plasmodium falciparum dihydrofolate reductase: Structural basis of antifolate resistance

by Giulio Rastelli, Worachart Sirawaraporn, Pornthep Sompornpisut, Tirayut Vilaivan, Sumalee Kamchonwongpaisan, Rachel Quarrell, Gordon Lowe, Yodhathai Thebtaranonth, Yongyuth Yuthavong
Published 2018

Molecular dynamics of human dihydrofolate reductase

by Atchara Wijitkosoom
Published 2010

Molecular modeling and molecular dynamics simulation of voltage sensor domain of sodium channel in activated and resting states

by Wannaruedee Wannapukdee
Published 2013