Macrocyclic effect and conformational analysis of the mixed-donor macrocycle 12-ane N<inf>2</inf>O<inf>2</inf>by means of quantum chemical methods

by Supot Hannongbua
Published 2018

Conformational diversity of cyclodextrins for applications in food and pharmaceutical industries : Research report (completed)

by Supot Hannongbua
Published 2015

Ab initio study of ion-ammonia complexes: Geometry and many-body interactions

by Teerakiat Kerdcharoen, Supot Hannongbua
Published 2018

Monte Carlo simulations of a magnesium ion in liquid ammonia

by Supot Hannongbua, Bernd M. Rode
Published 2018

A study of the influence of Na[superscript +] on the conformation of glycine zwitterion in aqueous solution

by Sirirat Kokpol, Supot Hannongbua, Prayong Doungdee
Published 2009

Simulations of liquid ammonia based on the combined Quantum Mechanical/Molecular Mechanical (QM/MM) approach

by Anan Tongraar, Teerakiat Kerdcharoen, Supot Hannongbua
Published 2018

The hydration structure of 18-crown-6/K⁺complex as studied by Monte Carlo simulation using ab initio fitted potential

by Sriprajak Krongsuk, Teerakiat Kerdcharoen, Supot Hannongbua
Published 2018

How many water molecules in the hydration shell of 18-crown-6? Monte Carlo simulations based on ab initio-derived potential energy surface

by Sriprajak Krongsuk, Teerakiat Kerdcharoen, Supot Hannongbua
Published 2018

Charge transfer, polarizability and stability of Li-C<inf>60</inf>complexes

by Thammarat Aree, Teerakiat Kerdcharoen, Supot Hannongbua
Published 2018

A study of the influence of Na[superscript +] on the conformation of glycine zwitterion in aqueous solution

by Sirirat Kokpol, Supot Hannongbua, Prayong Doungdee
Published 1987

Litchi chinensis-derived terpenoid as anti-HIV-1 protease agent: Structural design from molecular dynamics simulations

by Piyarat Nimmanpipug, Vannajan S. Lee, Peter Wolschann, Supot Hannongbua
Published 2018

Litchi chinensis-derived terpenoid as anti-HIV-1 protease agent: Structural design from molecular dynamics simulations

by Piyarat Nimmanpipug, Vannajan S. Lee, Peter Wolschann, Supot Hannongbua
Published 2018

Effect of D168V mutation in NS3/4A HCV protease on susceptibilities of faldaprevir and danoprevir

by Arthitaya Meeprasert, Supot Hannongbua, Nawee Kungwan, Thanyada Rungrotmongkol
Published 2018

Role of R292K mutation in influenza H7N9 neuraminidase toward oseltamivir susceptibility: MD and MM/PB(GB)SA study

by Jiraphorn Phanich, Thanyada Rungrotmongkol, Nawee Kungwan, Supot Hannongbua
Published 2018

Protein–protein interactions between SWCNT/chitosan/EGF and EGF receptor: a model of drug delivery system

by Chompoonut Rungnim, Thanyada Rungrotmongkol, Nawee Kungwan, Supot Hannongbua
Published 2018

Solvation structures of the 18-crown-6 in carbon tetrachloride as studied by Monte-Carlo simulation based on ab initio potential models

by Sriprajak Krongsuk, Teerakiat Kerdcharoen, Michael Kiselev, Supot Hannongbua
Published 2018

Conformational analysis of Be(II) and Mg(II) complexes of N-acetyl alanine methyl ester

by Sirirat Kokpol, Supot Hannongbua, Wutichai Yentongchai, B. M. Rode
Published 2018

Structure and electronic properties of deformed single-walled carbon nanotubes: quantum calculations

by Somphob Thompho, Oraphan Saengsawang, Thanyada Rungrotmongkol, Nawee Kungwan, Supot Hannongbua
Published 2018

Glycan binding and specificity of viral influenza neuraminidases by classical molecular dynamics and replica exchange molecular dynamics simulations

by Jiraphorn Phanich, Siraphob Threeracheep, Nawee Kungwan, Thanyada Rungrotmongkol, Supot Hannongbua
Published 2018

Molecular and electronic properties of HIV-1 protease inhibitor C<inf>60</inf>derivatives as studied by the ONIOM method

by Siriporn Promsri, Parawan Chuichay, Vannajan Sanghiran, Vudhichai Parasuk, Supot Hannongbua
Published 2018