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

بواسطة Supot Hannongbua
منشور في 2018

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

بواسطة Teerakiat Kerdcharoen, Supot Hannongbua
منشور في 2018

Monte Carlo simulations of a magnesium ion in liquid ammonia

بواسطة Supot Hannongbua, Bernd M. Rode
منشور في 2018

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

بواسطة Sirirat Kokpol, Supot Hannongbua, Prayong Doungdee
منشور في 2009

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

بواسطة Anan Tongraar, Teerakiat Kerdcharoen, Supot Hannongbua
منشور في 2018

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

بواسطة Sriprajak Krongsuk, Teerakiat Kerdcharoen, Supot Hannongbua
منشور في 2018

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

بواسطة Sriprajak Krongsuk, Teerakiat Kerdcharoen, Supot Hannongbua
منشور في 2018

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

بواسطة Thammarat Aree, Teerakiat Kerdcharoen, Supot Hannongbua
منشور في 2018

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

بواسطة Piyarat Nimmanpipug, Vannajan S. Lee, Peter Wolschann, Supot Hannongbua
منشور في 2018

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

بواسطة Piyarat Nimmanpipug, Vannajan S. Lee, Peter Wolschann, Supot Hannongbua
منشور في 2018

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

بواسطة Arthitaya Meeprasert, Supot Hannongbua, Nawee Kungwan, Thanyada Rungrotmongkol
منشور في 2018

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

بواسطة Jiraphorn Phanich, Thanyada Rungrotmongkol, Nawee Kungwan, Supot Hannongbua
منشور في 2018

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

بواسطة Chompoonut Rungnim, Thanyada Rungrotmongkol, Nawee Kungwan, Supot Hannongbua
منشور في 2018

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

بواسطة Sriprajak Krongsuk, Teerakiat Kerdcharoen, Michael Kiselev, Supot Hannongbua
منشور في 2018

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

بواسطة Sirirat Kokpol, Supot Hannongbua, Wutichai Yentongchai, B. M. Rode
منشور في 2018

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

بواسطة Somphob Thompho, Oraphan Saengsawang, Thanyada Rungrotmongkol, Nawee Kungwan, Supot Hannongbua
منشور في 2018

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

بواسطة Jiraphorn Phanich, Siraphob Threeracheep, Nawee Kungwan, Thanyada Rungrotmongkol, Supot Hannongbua
منشور في 2018

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

بواسطة Siriporn Promsri, Parawan Chuichay, Vannajan Sanghiran, Vudhichai Parasuk, Supot Hannongbua
منشور في 2018

Molecular dynamic simulations analysis of ritronavir and lopinavir as SARS-CoV 3CL^proinhibitors

بواسطة Veena Nukoolkarn, Vannajan Sanghiran Lee, Maturos Malaisree, Ornjira Aruksakulwong, Supot Hannongbua
منشور في 2018

Molecular dynamic simulations analysis of ritronavir and lopinavir as SARS-CoV 3CL^proinhibitors

بواسطة Veena Nukoolkarn, Vannajan Sanghiran Lee, Maturos Malaisree, Ornjira Aruksakulwong, Supot Hannongbua
منشور في 2018