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Thermodynamic Properties of Vapor-Liquid Equilibria from Monte-Carlo Simulation using ab initio Intermolecular Potentials of Systems H2-H2 and F2-F2

Zeitschrift für physikalische Chemie (Neue Folge), 2019-04, Vol.233 (4), p.493-525

2019

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A density functional theory study on silver and bis-silver complexes with lighter tetrylene: are silver and bis-silver carbenes candidates for SARS-CoV-2 inhibition? Insight from molecular docking simulation

RSC advances, 2020-08, Vol.1 (51), p.3961-3974

2020

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Synthesis, Docking Study, Cytotoxicity, Antioxidant, and Anti-microbial Activities of Novel 2,4-Disubstituted Thiazoles Based on Phenothiazine

Current organic synthesis, 2020-01, Vol.17 (2), p.151-159

2020

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The performance of classification and forecasting Dong Nai River water quality for sustainable water resources management using neural network techniques

Journal of hydrology (Amsterdam), 2021-05, Vol.596, p.126099, Article 126099

2021

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In-Depth Investigation of a Donor–Acceptor Interaction on the Heavy-Group-14@Group-13-Diyls in Transition-Metal Tetrylone Complexes: Structure, Bonding, and Property

ACS omega, 2020-08, Vol.5 (33), p.21271-21287

2020

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Investigation into SARS-CoV‑2 Resistance of Compounds in Garlic Essential Oil

ACS omega, 2020-04, Vol.5 (14), p.8312-8320

2020

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Calculation of thermodynamic properties of vapor-liquid equilibria using ab initio intermolecular potential energy surfaces for dimer O2-O2

Molecular physics, 2020-08, Vol.118 (16)

2020

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Calculation of intermolecular potentials for H 2 H 2 and H 2 O 2 dimers ab initio and prediction of second virial coefficients

Chemical physics, 2015-08, Vol.457, p.171-179

2015

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Thermodynamic Properties of Vapor-Liquid Equilibria from Monte-Carlo Simulation using ab initio Intermolecular Potentials of Systems H 2 -H 2 and F 2 -F 2

Zeitschrift für physikalische Chemie (Neue Folge), 2019-04, Vol.233 (4), p.493-525

2019

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Novel QSPR modeling of stability constants of metal-thiosemicarbazone complexes by hybrid multivariate technique: GA-MLR, GA-SVR and GA-ANN

Journal of molecular structure, 2019-11, Vol.1195, p.95-109

2019

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Design, virtual screening and in silico QSPR modeling for the development of new thiosemicarbazone‐based complexes

Vietnam journal of chemistry, 2023-07, Vol.61 (S1), p.8-16

2023

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Insight prediction of receptor binding activity of a set of benzamide derivatives using hybrid QSAR models: GA‐MLR and GA‐SVR

Vietnam journal of chemistry, 2020-04, Vol.58 (2), p.191-200

2020

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Insight QSDAR models for prediction of anticancer activity on Hela cell line of new flavonoid isolating from rhizome Zingiber zerumbet SM in Viet Nam

Indian journal of chemistry. Sect. B. Organic chemistry, including medicinal chemistry, 2021-10, Vol.60 (10)

2021

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Discovery of novel thiazole derivatives as anti‐breast cancer agents (MCF‐7) and validation of homologous effects on SARS‐CoV‐2 virus using in silico approaches

Vietnam journal of chemistry, 2023-07, Vol.61 (S1), p.17-29

2023

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Evaluation of the Inhibitory Activities of COVID‐19 of Melaleuca cajuputi Oil Using Docking Simulation

ChemistrySelect (Weinheim), 2020-06, Vol.5 (21), p.6312-6320

2020

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New triterpene sulfates from Vietnamese red alga Tricleocarpa fragilis and their α-glucosidase inhibitory activity

Journal of asian natural products research, 2021-08, Vol.23 (8), p.754-763

2021

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Ab Initio Intermolecular Potential Energy Surfaces and Cross Second Virial Coefficients for the Dimer N2-NO

ACS omega, 2020-06, Vol.5 (21), p.12539-12549

2020

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Ab Initio Intermolecular Potential Energy Surfaces and Cross Second Virial Coefficients for the Dimer N 2 -NO

ACS omega, 2020-06, Vol.5 (21), p.12539-12549

2020

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Theoretically predicted divalent silicon(0) compounds: Structures and chemical bonding of silylone in molybdenum pentacarbonyl complexes [Mo(CO)5-Si(XCp∗)2] (X = B–Tl)

Computational and theoretical chemistry, 2018-05, Vol.1131, p.13-24

2018

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Diagram of vapor‐liquid equilibria for n‐pentane using hybrid Gibbs ensemble Monte Carlo simulation

Vietnam journal of chemistry, 2020-02, Vol.58 (1), p.101-107

2020

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Theoretical assessment of donor–acceptor complexes [X(PPh3)2 → AlH2]+ (X = C–Pb): structures and bonding

Theoretical chemistry accounts, 2019-05, Vol.138 (5), p.1-15, Article 67

2019

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Evaluation of SARS‐CoV ‐2 inhibition of some compounds in CYMBOPOGON CITRATUS oil combining docking and molecular dynamics simulations

Vietnam journal of chemistry, 2021-12, Vol.59 (6), p.790-799

2021

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Evaluation of SARS‐CoV‐2 inhibition of some compounds inCYMBOPOGON CITRATUS oil combining docking and molecular dynamics simulations

Vietnam journal of chemistry, 2021-12, Vol.59 (6), p.790-799

2021

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An insight QSPR‐based prediction model for stability constants of metal‐thiosemicarbazone complexes using MLR and ANN methods

Vietnam journal of chemistry, 2019-08, Vol.57 (4), p.500-506

2019

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Spatial prediction of saline and sodic soils in rice‒shrimp farming land by using integrated artificial neural network/regression model and kriging

Archiv für Acker- und Pflanzenbau und Bodenkunde, 2018-02, Vol.64 (3), p.371-383

2018

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Thermodynamic Properties of Vapor-Liquid Equilibria from Monte-Carlo Simulation using ab initio Intermolecular Potentials of Systems H2-H2 and F2-F2

A density functional theory study on silver and bis-silver complexes with lighter tetrylene: are silver and bis-silver carbenes candidates for SARS-CoV-2 inhibition? Insight from molecular docking simulation

Synthesis, Docking Study, Cytotoxicity, Antioxidant, and Anti-microbial Activities of Novel 2,4-Disubstituted Thiazoles Based on Phenothiazine

The performance of classification and forecasting Dong Nai River water quality for sustainable water resources management using neural network techniques

In-Depth Investigation of a Donor–Acceptor Interaction on the Heavy-Group-14@Group-13-Diyls in Transition-Metal Tetrylone Complexes: Structure, Bonding, and Property

Investigation into SARS-CoV‑2 Resistance of Compounds in Garlic Essential Oil

Calculation of thermodynamic properties of vapor-liquid equilibria using ab initio intermolecular potential energy surfaces for dimer O2-O2

Calculation of intermolecular potentials for H 2 H 2 and H 2 O 2 dimers ab initio and prediction of second virial coefficients

Thermodynamic Properties of Vapor-Liquid Equilibria from Monte-Carlo Simulation using ab initio Intermolecular Potentials of Systems H 2 -H 2 and F 2 -F 2

Novel QSPR modeling of stability constants of metal-thiosemicarbazone complexes by hybrid multivariate technique: GA-MLR, GA-SVR and GA-ANN

Design, virtual screening and in silico QSPR modeling for the development of new thiosemicarbazone‐based complexes

Insight prediction of receptor binding activity of a set of benzamide derivatives using hybrid QSAR models: GA‐MLR and GA‐SVR

Insight QSDAR models for prediction of anticancer activity on Hela cell line of new flavonoid isolating from rhizome Zingiber zerumbet SM in Viet Nam

Discovery of novel thiazole derivatives as anti‐breast cancer agents (MCF‐7) and validation of homologous effects on SARS‐CoV‐2 virus using in silico approaches

Evaluation of the Inhibitory Activities of COVID‐19 of Melaleuca cajuputi Oil Using Docking Simulation

New triterpene sulfates from Vietnamese red alga Tricleocarpa fragilis and their α-glucosidase inhibitory activity

Ab Initio Intermolecular Potential Energy Surfaces and Cross Second Virial Coefficients for the Dimer N2-NO

Ab Initio Intermolecular Potential Energy Surfaces and Cross Second Virial Coefficients for the Dimer N 2 -NO

Theoretically predicted divalent silicon(0) compounds: Structures and chemical bonding of silylone in molybdenum pentacarbonyl complexes [Mo(CO)5-Si(XCp∗)2] (X = B–Tl)

Diagram of vapor‐liquid equilibria for n‐pentane using hybrid Gibbs ensemble Monte Carlo simulation

Theoretical assessment of donor–acceptor complexes [X(PPh3)2 → AlH2]+ (X = C–Pb): structures and bonding

Evaluation of SARS‐CoV ‐2 inhibition of some compounds in CYMBOPOGON CITRATUS oil combining docking and molecular dynamics simulations

Evaluation of SARS‐CoV‐2 inhibition of some compounds inCYMBOPOGON CITRATUS oil combining docking and molecular dynamics simulations

An insight QSPR‐based prediction model for stability constants of metal‐thiosemicarbazone complexes using MLR and ANN methods

Spatial prediction of saline and sodic soils in rice‒shrimp farming land by using integrated artificial neural network/regression model and kriging

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