Structure, dynamics and binding of drug resistance HIV-1 protease with major mutations

by Ornjira Aruksakunwong
Published 2011

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

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

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