Maturos Malaisree

Molecular dynamic simulations analysis of ritronavir and lopinavir as SARS-CoV 3CLpro inhibitors

Veena Nukoolkarn, Vannajan Sanghiran Lee, Maturos Malaisree et al. · Journal of Theoretical Biology · 2008 · 195 citations · Full text

Medicine, Pharmacokinetics, Pharmacology +14

A water-swap reaction coordinate for the calculation of absolute protein–ligand binding free energies

Christopher Woods, Maturos Malaisree, Supot Hannongbua et al. · The Journal of Chemical Physics · 2011 · 97 citations

Pharmacy, Biochemistry, Medicinal Chemistry +16

Rapid decomposition and visualisation of protein–ligand binding free energies by residue and by water

Christopher Woods, Maturos Malaisree, Julien Michel et al. · Faraday Discussions · 2014 · 91 citations · Full text

Natural Sciences, Biophysics, Chemistry +17

How amantadine and rimantadine inhibit proton transport in the M2 protein channel

Pathumwadee Intharathep, Chittima Laohpongspaisan, Thanyada Rungrotmongkol et al. · Journal of Molecular Graphics and Modelling · 2008 · 78 citations

Medicine, Biochemistry, Pharmacology +14

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 calculations

Thanyada Rungrotmongkol, Nadtanet Nunthaboot, Maturos Malaisree et al. · Journal of Molecular Graphics and Modelling · 2010 · 62 citations

Life Sciences, Biochemistry, Molecular Biology +17