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تعداد موارد: ۱۲۵

Methane hydrate formation between graphene oxide nanosheets: Insights from molecular dynamics simulations

Journal of Molecular Liquids

مجلات خارجی 2024 December Volume (415) Pages (126317-126334)

Dopamine interaction with DNA/RNA aptamers: Molecular dynamics simulation

Computational and Theoretical Chemistry

مجلات خارجی 2024 November

Pharmaceutically active compounds removal from aqueous solutions by MIL-101(Cr)-NH2: A molecular dynamics study

Ecotoxicology and Environmental Safety

مجلات خارجی 2024 June Volume (278) No (2) Pages (116333-116341)

Molecular simulation of CO2 capturing by dual functionalized phosphonium-based amino acid ionic liquids

Materials Today Communications

مجلات خارجی 2023 December Volume (37) No (1) Pages (106945-106958)

AR13 peptide-conjugated liposomes improve the antitumor efficacy of doxorubicin in mice bearing C26 colon carcinoma; in silico, in vitro, and in vivo study

Toxicology and Applied Pharmacology

مجلات خارجی 2023 May Volume (466) Pages (116470-)

Does side chain group of anion affect absorption of SO2 in amino acid ionic liquid?

Journal of Molecular Liquids

مجلات خارجی 2023 April Volume (376) Pages (121479-121479-12)

Adsorption of an Azo Dye on Graphene Nanosheet: A Molecular Dynamics Simulation Study

Physical Chemistry Research

مجلات خارجی 2023 March Volume (11) No (1) Pages (117-127)

Cation functional group effect on SO2 absorption in amino acid ionic liquids

Frontiers in Chemistry

مجلات خارجی 2023 February Volume (11)

Elaboration of entropy with glass composition: A molecular dynamics study

Materials Today Communications

مجلات خارجی 2022 December Volume (33) No (2) Pages (104340-104348)

Adsorption and diffusion of the H2/CO2/CO/MeOH/EtOH mixture into the ZIF-7 using molecular simulation

Journal of Molecular Graphics and Modelling

مجلات خارجی 2022 November Volume (116) No (1) Pages (108275-108287)

Molecular dynamics simulation of drug delivery across the cell membrane by applying gold nanoparticle carrier: Flutamide as hydrophobic and glutathione as hydrophilic drugs as the case studies

Journal of Molecular Graphics and Modelling

مجلات خارجی 2022 November Volume (116) No (1) Pages (108271-108281)

Configurational entropy as a simple input data for glass science and engineering

Materials Today Communications

مجلات خارجی 2022 August Volume (32) No (10) Pages (104153-104160)

Molecular simulation of adsorption and diffusion of H2 /CO2 /CO /MeOH /EtOH mixture into the zeolitic imidazolate framework ZIF-8

Microporous and Mesoporous Materials

مجلات خارجی 2022 March Volume (333) No (3) Pages (111723-111736)

Ultra selective and high-capacity dummy template molecular imprinted polymer to control quorum sensing and biofilm formation of Pseudomonas aeruginosa

Analytica Chimica Acta

مجلات خارجی 2022 March Volume (1199) Pages (339574-12)

Molecular dynamics study of SO2 gas adsorption in two Y Zeolites: Effects of external fields

Materials Today Communications

مجلات خارجی 2022 March Volume (30) No (1) Pages (103045-103045)

Molecular dynamic simulation studies of adsorption and diffusion behaviors of methanol and ethanol through ZSM-5 zeolite

Journal of Molecular Graphics and Modelling

مجلات خارجی 2022 January Volume (110) Pages (108048-108056)

Study of SO2 into nanoporous silica Y Zeolite: Molecular dynamics simulation

Results in Chemistry

مجلات خارجی 2022 January Volume (4) No (1) Pages (100283-100283)

Mixed membrane matrices (MMMs) based on Nafion® pristine/defected-UiO-66(Zr) MOFs: assessment of the effects of dopants on cluster morphology

Molecular Systems Design and Engineering

مجلات خارجی 2022 January Volume (7) No (8) Pages (969-985)

In silico study and experimental evaluation of the solution combustion synthesized manganese oxide (MnO2) nanoparticles

Ceramics International

مجلات خارجی 2022 January Volume (48) No (2) Pages (1659-1672)

The effect of anion on aggregation of amino acid ionic liquid: Atomistic simulation

Journal of Molecular Graphics and Modelling

مجلات خارجی 2020 December Volume (101) No (1) Pages (107733-107733)

Potential of diamines for absorption of SO2: Effect of methanol group

Journal of Molecular Liquids

مجلات خارجی 2020 December Volume (319) No (1) Pages (114163-114163)

Catalyst-free green synthesis of tetrahydro-benzo[b]pyrans in magnetized water: experimental aspects and molecular dynamics simulation

Research on Chemical Intermediates

مجلات خارجی 2019 May Volume (45) No (5) Pages (2981-2997)

Effect of low dose gamma ray on the plasmonic behavior of gold nanoparticle

Radiation Physics and Chemistry

مجلات خارجی 2019 March Volume (159) No (1) Pages (190-194)

Atomistic simulation of proton transfer ability of Isopoly acid (IPA)/Heteropoly acid (HPA) doped Nafion® 117 for high-temperature fuel cell applications

Composites Part B: Engineering

مجلات خارجی 2019 March Volume (161) No (1) Pages (402-410)

Does the addition of a heteropoly acid change the water percolation threshold of PFSA membranes?

Physical Chemistry Chemical Physics

مجلات خارجی 2019 January Volume (21) No (45) Pages (25080-25089)

Elucidating the morphological aspects and proton dynamics in a hybrid perfluorosulfonic acid membrane for medium-temperature fuel cell applications

Physical Chemistry Chemical Physics

مجلات خارجی 2018 November Volume (20) No (1) Pages (29778-29789)

What is the effect of polar and nonpolar side chain group on bulk and electrical double layer properties of amino acid ionic liquids?

Electrochimica Acta

مجلات خارجی 2018 August Volume (285) No (1) Pages (393-404)

Interaction of longitudinal phonons with discrete breather in strained graphene

European Physical Journal B

مجلات خارجی 2018 July Volume (91) No (7) Pages (1-7)

Structural analysis of an amino acid ionic liquid: Bulk and electrical double layer

Journal of Molecular Liquids

مجلات خارجی 2018 July Volume (268) Pages (506-516)

CO2 gas adsorption into graphene oxide framework: Effect of electric and magnetic field

Applied Surface Science

مجلات خارجی 2018 June Volume (456) No (1) Pages (318-327)

Metal- and catalyst-free, one-pot, three-component synthesis of propargylamines in magnetized water: experimental aspects and molecular dynamics simulation

New Journal of Chemistry

مجلات خارجی 2018 March Volume (42) No (6) Pages (4559-4566)

Tunable gas adsorption in graphene oxide framework

Applied Surface Science

مجلات خارجی 2018 February Volume (443) Pages (198-208)

Effect of Magnetized Ethanol on the Shape Evolution of Zinc Oxide from Nanoparticles to Microrods: Experimental and Molecular Dynamic Simulation Study

Advanced Powder Technology

مجلات خارجی 2018 February Volume (29) No (2) Pages (349-358)

Magnetic field effect on the structural properties of a peptide model: Molecular dynamics simulation study

Journal of Molecular Structure

مجلات خارجی 2018 February Volume (1161) No (5) Pages (393-402)

Synthesis and DFT Study on Hantzsch Reaction to Produce Asymmetrical Compounds of 1,4-Dihydropyridine Derivatives for P-Glycoprotein Inhibition as Anticancer Agent

Recent Patents on Anti-Cancer Drug Discovery

مجلات خارجی 2018 February Volume (13) No (2) Pages (255-264)

The effects of temperature, alkyl chain length, and anion type on thermophysical properties of the imidazolium based amino acid ionic liquids

Journal of Molecular Liquids

مجلات خارجی 2018 January Volume (250) No (1) Pages (121-130)

Does electric or magnetic field affect reverse osmosis desalination?

Desalination

مجلات خارجی 2018 January Volume (432) No (1) Pages (55-63)

Water Dynamics and Proton‐Transport Mechanisms of Nafion 117/Phosphotungstic Acid Composite Membrane: A Molecular Dynamics Study

ChemPhysChem

مجلات خارجی 2017 December Volume (18) No (23) Pages (3485-3497)

Molecular Dynamics Simulation of Keggin HPA Doped Nafion® 117 as Polymer Electrolyte Membrane

RSC Advances

مجلات خارجی 2017 September Volume (7) No (70) Pages (44537-44546)

The variation of surface free energy of Al during superhydrophobicity processing

Chemical Engineering Journal

مجلات خارجی 2017 August Volume (322) Pages (181-187)

A new method for preparing mono-dispersed nanoparticles using magnetized water

Applied Physics A: Materials Science and Processing

مجلات خارجی 2017 April Volume (123) No (4) Pages (1-12)

The role of hydrogen bond interaction on molecular orientation of alkanolamines through temperature and pressure variation: A mixed molecular dynamics and quantum mechanics study

Computational Materials Science

مجلات خارجی 2017 February Volume (131) No (3) Pages (239-249)

What is the effect of carbon nanotube shape on desalination process? A simulation approach

Desalination

مجلات خارجی 2017 January Volume (407) No (1) Pages (103-115)

Molecular dynamics simulation of amino acid ionic liquids near a graphene electrode: effects of alkyl side-chain length

Physical Chemistry Chemical Physics

مجلات خارجی 2016 November Volume (18) No (48) Pages (33053-33067)

Glycerol revisited molecular dynamic simulations of structural, dynamical, and thermodynamic properties

Journal of the Iranian Chemical Society

مجلات خارجی 2016 August Volume (14) No (1) Pages (1-7)

Molecular dynamics simulation study: The decryption of bi and tri aromatics behavior with NaX zeolite

Journal of Molecular Graphics and Modelling

مجلات خارجی 2016 August Volume (69) No (1) Pages (61-71)

Structural and transport properties and solubility parameter of graphene / glycerol nanofluids: A molecular dynamics simulation study

Journal of Molecular Liquids

مجلات خارجی 2016 July Volume (222) No (10) Pages (82-87)

Transport, thermodynamic, and structural properties of rare earth zirconia-based electrolytes by molecular dynamics simulation

International Journal of Energy Research

مجلات خارجی 2016 May Volume (40) No (12) Pages (1712-1723)

The effect of various quantum mechanically derived partial atomic charges on the bulk properties of chloride-based ionic liquids

Chemical Physics

مجلات خارجی 2016 May Volume (475) No (1) Pages (23-31)

Site specific interaction of aromatic amino acids with ZnO nanotubes: A density functional approach

Computational and Theoretical Chemistry

مجلات خارجی 2016 April Volume (1086) No (1) Pages (36-44)

Exploring the sensitivity of ZnO nanotubes to tyrosine nitration: ADFT approach

physics letters A

مجلات خارجی 2016 April Volume (380) No (24) Pages (2090-2097)

Molecular dynamics simulation study: The reactivation of NaX zeolitecontaminated by bi and tri aromatics using supercritical fluidextraction

Journal of Supercritical Fluids

مجلات خارجی 2016 March Volume (112) No (1) Pages (103-113)

Identification of the coke deposited on 13X industrial zeolite molecular sieves during mercaptan removal process

Asia-Pacific Journal of Chemical Engineering

مجلات خارجی 2016 March Volume (11) No (2) Pages (164-178)

Magnetized property effect of a non-aqueous solvent upon complex formation between kryptofix 22DD with lanthanum(III) cation: experimental aspects and molecular dynamics simulation

RSC Advances

مجلات خارجی 2016 February Volume (6) No (11) Pages (9096-9105)

Structural View of Hydrophobic Ionic Liquid on Graphene: Comparing Static and Ab Initio Computer Simulations

ECS Journal of Solid State Science and Technology

مجلات خارجی 2015 September Volume (4) No (12) Pages (M77-M87)

Why is the electroanalytical performance of carbon paste electrodes involving ionic liquid binder higher than paraffinic binders? a simulation investigation

، ، ، Fatemeh Moosavi

Physical Chemistry Chemical Physics

مجلات خارجی 2015 July Volume (17) No (1) Pages (24722-24731)

Carbon dioxide in monoethanolamine: Interaction and its effect onstructural and dynamic properties by molecular dynamics simulation

International Journal of Greenhouse Gas Control

مجلات خارجی 2015 June Volume (37) No (1) Pages (158-169)

Nd2-xGdxZr2O7 electrolytes: Thermal expansion and effect of temperature and dopant concentration on ionic conductivity of oxygen

International Journal of Hydrogen Energy

مجلات خارجی 2014 May Volume (39) No (16) Pages (8437-8448)

Molecular Dynamics Study of Complex Dopant Electrolyte Nd2–xHoxZr2O7: Structure, Conductivity, and Thermal Expansion

Fuel Cells

مجلات خارجی 2013 December Volume (13) No (6) Pages (1048-1055)

Magnetic effects on the solvent properties investigated by molecular dynamics simulation

Journal of Magnetism and Magnetic Materials

مجلات خارجی 2013 December Volume (354) No (1) Pages (239-247)

Synthesis, characterization and the interaction of some new water-soluble metal Schiff base complexes with human serum albumin

، ، ، ، Fatemeh Moosavi ،

Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy

مجلات خارجی 2013 November Volume (122) No (1) Pages (118-129)

Thermodynamic properties for liquid mercury using GMA equation of state

Physics and Chemistry of Liquids

مجلات خارجی 2013 January Volume (51) No (3) Pages (349-364)

Vanadyl Binary Schiff Base Complexes Containing N2O2 Coordination Sphere: Synthesis, Ab Initio Calculations and Thermodynamic Properties

، ، ، ، Fatemeh Moosavi

Journal of the Korean Chemical Society

مجلات خارجی 2013 January Volume (57) No (1) Pages (63-72)

Synthesis and characterization of some new Schiff base complexes of group 13 elements, ab initio studies, cytotoxicity and reaction with hydrogen peroxide

، ، ، ، Fatemeh Moosavi ، ،

Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy

مجلات خارجی 2012 September Volume (101) Pages (394-399)

Molecular dynamics simulation studies of some new aspects of structural and dynamical properties of n-butyl formate at varying temperature

Journal of Molecular Liquids

مجلات خارجی 2012 March Volume (167) Pages (5-13)

Studies of structural, dynamical, and interfacial properties of 1-alkyl-3-methylimidazolium iodide ionic liquids by molecular dynamics simulation

، ، Fatemeh Moosavi ،

Journal of Chemical Physics

مجلات خارجی 2012 March Volume (136) No (12) Pages (124706-124706)

Phase Equilibria and PVTPredictions for Liquid Fluorine Using GMA Equation of State

Journal of Physical Chemistry and Electrochemistry

مجلات خارجی 2011 August Volume (1) No (3) Pages (129-137)

A perturbed hard-sphere equation of state for liquid metals

Physics and Chemistry of Liquids

مجلات خارجی 2011 May Volume (49) No (3) Pages (347-354)

Physisorption of Hydrophobic and Hydrophilic 1-alkyl-3-methylimidazolium Ionic Liquids on the Graphite Plate Surface

Journal of Physical Chemistry C

مجلات خارجی 2011 March Volume (115) No (13) Pages (5626-5636)

The extent of molecular orientation at liquid/vapor interface of pyridine and its alkyl derivatives by molecular dynamics simulation

، ، Fatemeh Moosavi ،

Journal of Chemical Physics

مجلات خارجی 2011 February Volume (134) No (7) Pages (074707-74707)

Synthesis, ab initio Calculations, Thermal, Thermodynamic and Antioxidant Properties of Some Oxovanadium(IV) Complexes Containing N2O2 Set of Donor Atoms

، ، ، ، Fatemeh Moosavi

Journal of the Iranian Chemical Society

مجلات خارجی 2010 December Volume (7) No (4) Pages (1021-1035)

Critical Point Temperature of Ionic Liquids from Surface Tension at Liquid-Vapor Equilibrium and the Correlation with Interaction Energy

، Fatemeh Moosavi ، ،

Industrial and Engineering Chemistry Research

مجلات خارجی 2010 October Volume (49) No (24) Pages (12696-12701)

Temperature-Dependent Density and Viscosity of the Ionic Liquids 1-Alkyl-3-methylimidazolium Iodides: Experiment and Molecular Dynamics Simulation

، ، Fatemeh Moosavi ،

Journal of Chemical and Engineering Data

مجلات خارجی 2010 June Volume (55) No (9) Pages (3084-3088)

Synthesis, Characterization, Ab initio Calculations, Thermal Behavior and Thermodynamics of Some Oxovanadium(IV) Complexes Involving O,O- and N,N-Donor Moieties

، ، ، ، Fatemeh Moosavi

Journal of Chemical Sciences

مجلات خارجی 2010 March Volume (122) No (4) Pages (539-548)

Temperature dependence of viscosity and relation with the surface tension of ionic liquids

، ، ، Fatemeh Moosavi

Fluid Phase Equilibria

مجلات خارجی 2010 January Volume (291) No (2) Pages (188-194)

Prediction of the volumetric and thermodynamic properties of some refrigerants using GMA equation of state

International Journal of Refrigeration

مجلات خارجی 2007 March Volume (30) No (2) Pages (377-383)

Prediction of thermodynamic properties of some hydrofluoroether refrigerants using a new equation of state

Fluid Phase Equilibria

مجلات خارجی 2005 November Volume (238) No (1) Pages (112-119)

Theoretical insight into the deep eutectic solvent based on choline chloride: Malic acid and its role in the transport performance of the antibiotic ciprofloxacin from water

12th International Chemical Engineering Congress & Exhibition

کنفرانس های خارجی | 2023-12-13

Removal of Carbon Dioxide by Phosphonium-Based Amino Acid Ionic Liquids: Molecular Dynamics Simulation

یست و سومین کنفرانس شیمی فیزیک

کنفرانس های خارجی | 2022-01-12

Biocompatible Adsorbent for Drug Storage and Removal Applications: A Molecular Dynamics Study

10th Natinal Biennial Seminar (Webinar) of Chemistry and Environment

کنفرانس های خارجی | 2021-11-01

Comparing Solvents for SO2 Absorption by Molecular Dynamics Simulation

The 11th International Chemical Engineering Congress & Exhibition (IChEC 2020)

کنفرانس های خارجی | 2020-10-28

Aptamers Can Monitor Ionization Radiation

15th CBC Conference on Biophysical Chemistry

کنفرانس های خارجی | 2018-10-23

Comparison of SO2 and CO2 absorption by diamines

بیست و یکمین کنفرانس شیمی فیزیک

کنفرانس های خارجی | 2018-09-06

Comparing the reactivity of SO2-amine and CO2-amine compounds

بیست و یکمین کنفرانس شیمی فیزیک

کنفرانس های خارجی | 2018-09-06

The effect of temperature on cation aggregation in dodecyl betaine Nacyl glycinate amino acid ionic liquid: Molecular dynamics simulation investigation

بیستمین کنگره شیمی ایران

کنفرانس های خارجی | 2018-07-17

The effect of functionalizing graphene nanosheets on adsorption of Hydroxynaphtol Blue dye, A molecular dynamics simulation

بیستمین کنگره شیمی ایران

کنفرانس های خارجی | 2018-07-17

Effect of alkyl chain length on aggregation behavior of amino acid ionic liquid surfactant by molecular dynamics simulation

بیستمین کنگره شیمی ایران

کنفرانس های خارجی | 2018-07-17

Interactions between water and dye atoms in the adsorption process of Acid Red-88 on graphene nanosheet: A molecular dynamics simulation

بیستمین کنگره شیمی ایران

کنفرانس های خارجی | 2018-07-17

Molecular dynamics as a tool to study effect of Na+ cations on diffusion of SO2 in Y zeolite

بیستمین کنگره شیمی ایران

کنفرانس های خارجی | 2018-07-17

Comparing graphene and graphene oxide nanosheets in dye adsorption: Molecular dynamics simulation study

هفتمین کنگرۀ بین ­المللی رنگ و پوشش

کنفرانس های خارجی | 2017-12-19

Adsorption of ACID-RED 88 on graphene nanosheet: A molecular dynamics simulation

هفتمین کنگرۀ بین ­المللی رنگ و پوشش

کنفرانس های خارجی | 2017-12-19

Temperature and anion type effect on thermophysical properties of the imidazolium based amino acid ionic liquids

پنجمین همایش تخصصی ترمودینامیک

کنفرانس های خارجی | 2017-11-22

A Molecular Dynamics Study of SO2 Sorbed in Nonporous Silica Y Zeolite: Temperature and Loading Dependence

بیستمین کنفرانس شیمی فیزیک ایران

کنفرانس های خارجی | 2017-08-20

Molecular Dynamics Studies of Cation Aggregation in two Amino Acid Ionic Liquids

بیستمین کنفرانس شیمی فیزیک ایران

کنفرانس های خارجی | 2017-08-20

Structural properties of quercetin by molecular dynamics simulation

نوزدهمین کنفرانس شیمی فیزیک

کنفرانس های خارجی | 2016-09-13

Molecular Dynamic Study of [EMIM]+[PF6]- Ionic Liquid near a Monolayer Graphene Surface

یازدهمین سمینار سالانه الکتروشیمی ایران

کنفرانس های خارجی | 2015-11-18

Structural and Dynamic Investigation of [EMIM]+[PF6]-Electrolyte: An Atomistic Simulation

یازدهمین سمینار سالانه الکتروشیمی ایران

کنفرانس های خارجی | 2015-11-18

Cyclometalated Ruthenium (II) Electronic Structure Influence on dye-sensitized solar cell performance: A Density Functional Theory

نخستین کنفرانس بین المللی محیط زیست و منابع طبیعی

کنفرانس های خارجی | 2015-09-07

Solubility Parameter of Graphene: A MD Simulation Study

18th Iranian Chemistry Congress

کنفرانس های خارجی | 2015-08-30

Steric Effect in Ancillary Ligand on Cyclometalated Ruthenium (II) Sensitizers in Dye Sensitized Solar Cells

هفتمین سمینار شیمی و محیط زیست

کنفرانس های خارجی | 2015-08-26

Molecular Dynamics Simulation of CO2-MEA Mixtures: Structural View

17th Iranian Physical Chemistry Conference

کنفرانس های خارجی | 2014-10-21

Structure and Dynamic Behaviour of Hydrophobic Ionic Liquids Adsorbed on Graphene Surface

3rd ScienceOne International Conference on Environmental Sciences

کنفرانس های خارجی | 2014-01-21

Aniline Adsorption on the End-capped(6,6) single wallCarbon Nanotube; A Theoretical Study

The 16th Iranian Chemistry Congress

کنفرانس های خارجی | 2013-09-07

Asphaltene Dispersion via Atomistic Simulation in Benzene

دومین همایش ملی نفت، گاز و پتروشیمی

کنفرانس های خارجی | 2013-03-06

Alkyl chain length, anion, and cation type effects on mercury extraction by ionic liquids

5th Environmental Chemistry Congress

کنفرانس های خارجی | 2011-12-21

Hydrophobicity and hydrophilicity in ionic liquids: car-parrinello and classical molecular dynamics simulation

CPMD2011

کنفرانس های خارجی | 2011-09-05

Ionic liquids-solvent for future: thermophysical, structure, and electronic properties

15th Iranian Chemistry Congress

کنفرانس های خارجی | 2011-09-04

Physisorption of hydrophobic and hydrophilic imidazolium based ionic liquids on the circumcoronene surface

14th Conference on Physical Chemistry

کنفرانس های خارجی | 2011-02-25

The correlation of interaction energy with critical point temperature of ionic liquids obtained from surface tension

14th Conference on Physical Chemistry

کنفرانس های خارجی | 2011-02-25

Molecular dynamic simulation of bulk and surface structure of the ionic liquids 1-alkyl-3-methylimidazolium iodides

14th Conference on Physical Chemistry

کنفرانس های خارجی | 2011-02-25

Bulk and Surface Properties of Formate Esters by the Application of SAFT-VR and Molecular Dynamics Simulation

13th Conference on Physical Chemistry

کنفرانس های خارجی | 2010-04-12

Active C-H bond and rational of the anion-cation structural pattern in the ionic liquids 1-alkyl-3-methylimidazolium Chloride

13th Conference on Physical Chemistry

کنفرانس های خارجی | 2010-04-12

Calculation of Thermodynamic Properties of Refrigerants

2nd Regional Chemistry Conference

کنفرانس های خارجی | 2007-12-12

Review of some theoretical equations of state for polystyrene

8th Conference on Physical Chemistry

کنفرانس های خارجی | 2005-11-21

Pressure-Volume-Temperature and Thermodynamic Properties of Some Refrigerants Using an Equation of State

International Conference on Chemistry and Industry

کنفرانس های خارجی | 2004-12-11

Prediction of Thermodynamic Properties of Several Hydrofluoroether (HFE) Refrigerants Using a New Equation of State

18th IUPAC Conference on Chemical Thermodynamics, ICCT

کنفرانس های خارجی | 2004-08-17

محاسبه ویژگی های‎ ترمودینامیکی خنک‌کننده‌های R236ea, R245ca, R245fa

پژوهش های کاربردی در شیمی

مجلات داخلی | اسفند ۱۳۹۸ دوره (2) شماره (2) صفحات (219-226)

تأثیر آنیون در برهمکنش مایعات یونی آمینواسیدی بر پایه‎ی ایمیدازولیوم با کارواکرول به کمک شبیه‎سازی دینامیک مولکولی

هجدهمین کنگره ملی مهندسی شیمی ایران

کنفرانس های داخلی | ۱۴۰۳/۰۷/۱۸

شبیه‎سازی دینامیک مولکولی بررسی برهمکنش مایعات یونی آمینواسیدی بر پایه‎ی آمونیوم با کارواکرول

هجدهمین کنگره ملی مهندسی شیمی ایران

کنفرانس های داخلی | ۱۴۰۳/۰۷/۱۸

شبیه سازی دینامیک مولکولی الکترولیتهای GdZr2O7 و Nd2Zr2O7: ساختار، هدایت یونی، انبساط حجمی

پنجمین همایش تخصصی ترمودینامیک

کنفرانس های داخلی | ۱۳۹۶/۰۹/۰۱

بررسی تئوری خواص دینامیکی و ریخت شناسی غشاء نافیون حاوی هتروپلی آنیون و ایزوپلی آنیون

پنجمین کنفرانس تخصصی ترمودینامیک

کنفرانس های داخلی | ۱۳۹۶/۰۹/۰۱

تعیین رفتار دارو های ضد سرطان سیس پلاتین در مجاورت نوکلئوتیدهای رشته ی DNAو چگونگی رفتار آنها در شرایط محیطی متفاوت با کمک روش های مکانیک کوانتوم

1st Nondrug Congress

کنفرانس های داخلی | ۱۳۸۹/۱۲/۰۶

بررسی برهم کنش های ترکیبات دارویی ضدسرطان با نانو لوله های کربنی توسط روش های شبیه سازی دینامیک مولکولی

1st Nondrug Congress

کنفرانس های داخلی | ۱۳۸۹/۱۲/۰۶

بررسی اثر ترکیبات دارویی ضد سرطانی 1-آریلیدن آمینو 2-آمینو ایمید ازول توسط روش های اصول اولیه ی شیمیایی

1st Nondrug Congress

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بررسی انتقالات فازی ترکیب دارویی ضدسرطان کلرید سزیم و اثرات نانولولههای کربنی بر این انتقالات فازی توسط روشهای دینامیک مولکولی

1st Nondrug Congress

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