Solid-liquid Equilibrium and Thermodynamic Analysis of Elastically Bendable Crystal Celecoxib in Thirteen Pure Solvents Based on Experiments and Molecular Simulation

Journal of Molecular Liquids ◽

10.1016/j.molliq.2021.116706 ◽

2021 ◽

pp. 116706

Author(s):

Xin Su ◽

Changyou Yu ◽

Pengwei Zhao ◽

Mengwei Wang ◽

Chenyang Zhao ◽

...

Keyword(s):

Molecular Simulation ◽

Thermodynamic Analysis ◽

Liquid Equilibrium ◽

Download Full-text

Assessment of solid–liquid equilibrium behavior of naphazoline nitrate in ten pure solvents by molecular simulation and thermodynamic analysis

Journal of Molecular Liquids ◽

10.1016/j.molliq.2021.118215 ◽

2021 ◽

pp. 118215

Author(s):

Yameng Wan ◽

Xiaoqiang Gao ◽

Xiaoxi Guo ◽

Fanfan Li ◽

Yi Cao ◽

...

Keyword(s):

Molecular Simulation ◽

Thermodynamic Analysis ◽

Liquid Equilibrium ◽

Equilibrium Behavior ◽

Download Full-text

Solid-liquid equilibrium behavior, thermodynamic analysis and molecular simulation of dimetridazole in twelve organic solvents

Journal of Molecular Liquids ◽

10.1016/j.molliq.2021.116252 ◽

2021 ◽

pp. 116252

Author(s):

Chenyang Zhao ◽

Jiawei Lin ◽

Ye Gao ◽

Shengzheng Guo ◽

Rongliang Liu ◽

...

Keyword(s):

Molecular Simulation ◽

Organic Solvents ◽

Thermodynamic Analysis ◽

Liquid Equilibrium ◽

Equilibrium Behavior ◽

Download Full-text

Thermodynamic analysis and molecular simulation of solid–liquid phase equilibrium of isoprenaline hydrochloride in eleven pure solvents at saturation

The Journal of Chemical Thermodynamics ◽

10.1016/j.jct.2021.106411 ◽

2021 ◽

Vol 160 ◽

pp. 106411

Author(s):

Renren Sun ◽

Haixia He ◽

Lei Yuan ◽

Yameng Wan ◽

Jiao Sha ◽

...

Keyword(s):

Phase Equilibrium ◽

Liquid Phase ◽

Molecular Simulation ◽

Thermodynamic Analysis ◽

Download Full-text

Solid-liquid equilibrium behavior and thermodynamic analysis of p-aminobenzoic acid using experimental measurement and molecular dynamic simulation

Journal of Molecular Liquids ◽

10.1016/j.molliq.2020.114964 ◽

2021 ◽

Vol 323 ◽

pp. 114964

Author(s):

Zongqiu Li ◽

Shengzhe Jia ◽

Ye Gao ◽

Mengwei Wang ◽

Wei Hong ◽

...

Keyword(s):

Molecular Dynamic Simulation ◽

Molecular Dynamic ◽

Dynamic Simulation ◽

Thermodynamic Analysis ◽

Experimental Measurement ◽

Aminobenzoic Acid ◽

Liquid Equilibrium ◽

Equilibrium Behavior ◽

Download Full-text

Solid-liquid equilibrium of 2,3-dimethoxybenzoic acid in fifteen mono-solvents: Determination, Correlation, Hansen solubility parameter, Molecular dynamic simulation and Thermodynamic analysis

Journal of Molecular Liquids ◽

10.1016/j.molliq.2021.118029 ◽

2021 ◽

pp. 118029

Author(s):

Yameng Wan ◽

Haixia He ◽

Xiaoqiang Gao ◽

Xiaoxi Guo ◽

Fanfan Li ◽

...

Keyword(s):

Molecular Dynamic Simulation ◽

Molecular Dynamic ◽

Dynamic Simulation ◽

Thermodynamic Analysis ◽

Solubility Parameter ◽

Liquid Equilibrium ◽

Hansen Solubility Parameter ◽

Solid Liquid ◽

Hansen Solubility

Download Full-text

Solid-liquid equilibrium for the ternary 2-naphthaldehyde + 2-methyl-1,4-naphthoquinone + ethanol system: Determination, correlation and molecular simulation

Journal of Molecular Liquids ◽

10.1016/j.molliq.2019.03.104 ◽

2019 ◽

Vol 284 ◽

pp. 131-138 ◽

Author(s):

Yi Yu ◽

Xiaoqiang Gao ◽

Zhouxuan Zang ◽

Li Xu ◽

Guoji Liu

Keyword(s):

Molecular Simulation ◽

Liquid Equilibrium ◽

Download Full-text

Solid-liquid equilibrium solubility, thermodynamic properties and molecular simulation of cis-5-norbornene-exo-2,3-dicarboxylic anhydride in thirteen pure solvents at various temperatures

The Journal of Chemical Thermodynamics ◽

10.1016/j.jct.2019.105967 ◽

2020 ◽

Vol 141 ◽

pp. 105967

Author(s):

Yameng Wan ◽

Pengshuai Zhang ◽

Haixia He ◽

Jiao Sha ◽

Rui Zhao ◽

...

Keyword(s):

Thermodynamic Properties ◽

Molecular Simulation ◽

Liquid Equilibrium ◽

Equilibrium Solubility ◽

Download Full-text

Solid–Liquid Equilibrium Solubility, Thermodynamic Properties, and Molecular Simulation of Phenylphosphonic Acid in 15 Pure Solvents at Different Temperatures

Journal of Chemical & Engineering Data ◽

10.1021/acs.jced.9b00362 ◽

2019 ◽

Vol 64 (12) ◽

pp. 5142-5159 ◽

Author(s):

Yameng Wan ◽

Pengshuai Zhang ◽

Haixia He ◽

Jiao Sha ◽

Kunpeng Yang ◽

...

Keyword(s):

Thermodynamic Properties ◽

Molecular Simulation ◽

Liquid Equilibrium ◽

Equilibrium Solubility ◽

Phenylphosphonic Acid ◽

Different Temperatures ◽

Download Full-text

Solid-liquid equilibrium solubility, thermodynamic properties, solvent effect and molecular simulation of (R)-(−)-phenylephrine hydrochloride in ten pure solvents ranged from 278.15 K to 323.15 K

The Journal of Chemical Thermodynamics ◽

10.1016/j.jct.2019.105959 ◽

2020 ◽

Vol 144 ◽

pp. 105959 ◽

Author(s):

Yameng Wan ◽

Rui Zhao ◽

Pengshuai Zhang ◽

Haixia He ◽

Jiao Sha ◽

...

Keyword(s):

Thermodynamic Properties ◽

Solvent Effect ◽

Molecular Simulation ◽

Liquid Equilibrium ◽

Equilibrium Solubility ◽

Phenylephrine Hydrochloride ◽

Download Full-text

Solid-liquid equilibrium of ropivacaine in fourteen organic solvents: An experimental and molecular simulation study

Journal of Molecular Liquids ◽

10.1016/j.molliq.2021.118163 ◽

2021 ◽

pp. 118163

Author(s):

Yan Wang ◽

Lun Cai ◽

Shichao Du ◽

Yan Cheng ◽

Peng Zhang ◽

...

Keyword(s):

Molecular Simulation ◽

Organic Solvents ◽

Simulation Study ◽

Liquid Equilibrium ◽

Download Full-text