In Silico Design of New Ionic Liquids Based on Quantitative Structure−Property Relationship Models of Ionic Liquid Viscosity

I. Billard; G. Marcou; A. Ouadi; A. Varnek

doi:10.1021/jp107868w

In Silico Design of New Ionic Liquids Based on Quantitative Structure−Property Relationship Models of Ionic Liquid Viscosity

The Journal of Physical Chemistry B ◽

10.1021/jp107868w ◽

2011 ◽

Vol 115 (1) ◽

pp. 93-98 ◽

Cited By ~ 37

Author(s):

I. Billard ◽

G. Marcou ◽

A. Ouadi ◽

A. Varnek

Keyword(s):

Ionic Liquid ◽

Ionic Liquids ◽

In Silico ◽

Liquid Viscosity ◽

Quantitative Structure ◽

Structure Property ◽

Quantitative Structure Property Relationship ◽

In Silico Design ◽

Property Relationship ◽

Structure Property Relationship

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Predictive Quantitative Structure–Property Relationship Model for the Estimation of Ionic Liquid Viscosity

Industrial & Engineering Chemistry Research ◽

10.1021/ie2025823 ◽

2012 ◽

Vol 51 (5) ◽

pp. 2470-2477 ◽

Cited By ~ 38

Author(s):

Seyyed Alireza Mirkhani ◽

Farhad Gharagheizi

Keyword(s):

Ionic Liquid ◽

Liquid Viscosity ◽

Quantitative Structure ◽

Structure Property ◽

Quantitative Structure Property Relationship ◽

Property Relationship ◽

Structure Property Relationship ◽

Relationship Model

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In silico predictions of tablet density using a quantitative structure–property relationship model

International Journal of Pharmaceutics ◽

10.1016/j.ijpharm.2018.12.087 ◽

2019 ◽

Vol 558 ◽

pp. 351-356

Author(s):

Yoshihiro Hayashi ◽

Yuki Marumo ◽

Takumi Takahashi ◽

Yuri Nakano ◽

Atsushi Kosugi ◽

...

Keyword(s):

In Silico ◽

Quantitative Structure ◽

Structure Property ◽

Quantitative Structure Property Relationship ◽

Property Relationship ◽

Structure Property Relationship ◽

Relationship Model ◽

In Silico Predictions

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Predicting the surface tensions of ionic liquids by the quantitative structure property relationship method using a topological index

Chemical Engineering Science ◽

10.1016/j.ces.2013.05.053 ◽

2013 ◽

Vol 101 ◽

pp. 266-270 ◽

Cited By ~ 19

Author(s):

Qiaoyan Shang ◽

Fangyou Yan ◽

Shuqian Xia ◽

Qiang Wang ◽

Peisheng Ma

Keyword(s):

Ionic Liquids ◽

Topological Index ◽

Quantitative Structure ◽

Structure Property ◽

Surface Tensions ◽

Quantitative Structure Property Relationship ◽

Property Relationship ◽

Structure Property Relationship

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A predictive quantitative structure–property relationship for glass transition temperature of 1,3-dialkyl imidazolium ionic liquids

Journal of Thermal Analysis and Calorimetry ◽

10.1007/s10973-012-2208-7 ◽

2012 ◽

Vol 111 (2) ◽

pp. 1639-1648 ◽

Cited By ~ 16

Author(s):

Seyed Mahmoud Mousavisafavi ◽

Farhad Gharagheizi ◽

Seyyed Alireza Mirkhani ◽

Jafar Akbari

Keyword(s):

Ionic Liquids ◽

Glass Transition ◽

Transition Temperature ◽

Glass Transition Temperature ◽

Quantitative Structure ◽

Structure Property ◽

Quantitative Structure Property Relationship ◽

Imidazolium Ionic Liquids ◽

Property Relationship ◽

Structure Property Relationship

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Evaluating the properties of ionic liquid at variable temperatures and pressures by quantitative structure–property relationship (QSPR)

Chemical Engineering Science ◽

10.1016/j.ces.2020.116326 ◽

2021 ◽

Vol 231 ◽

pp. 116326

Author(s):

Shuying Zhang ◽

Qingzhu Jia ◽

Fangyou Yan ◽

Shuqian Xia ◽

Qiang Wang

Keyword(s):

Ionic Liquid ◽

Quantitative Structure ◽

Structure Property ◽

Quantitative Structure Property Relationship ◽

Property Relationship ◽

Structure Property Relationship

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Quantitative Structure-Property Relationship for Predicting the Diffusion Coefficient of Ionic Liquids

Journal of Molecular Liquids ◽

10.1016/j.molliq.2022.118476 ◽

2022 ◽

pp. 118476

Author(s):

Yongjun Xiao ◽

Fan Song ◽

Shuhao An ◽

Fazhan Zeng ◽

Yingjie Xu ◽

...

Keyword(s):

Diffusion Coefficient ◽

Ionic Liquids ◽

Quantitative Structure ◽

Structure Property ◽

Quantitative Structure Property Relationship ◽

Property Relationship ◽

Structure Property Relationship

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Quantitative Structure–Property Relationship Studies on Ostwald Solubility and Partition Coefficients of Organic Solutes in Ionic Liquids

Journal of Chemical & Engineering Data ◽

10.1021/je700607b ◽

2008 ◽

Vol 53 (5) ◽

pp. 1085-1092 ◽

Cited By ~ 17

Author(s):

Alan R. Katritzky ◽

Minati Kuanar ◽

Iva B. Stoyanova-Slavova ◽

Svetoslav H. Slavov ◽

Dimitar A. Dobchev ◽

...

Keyword(s):

Ionic Liquids ◽

Partition Coefficients ◽

Organic Solutes ◽

Quantitative Structure ◽

Structure Property ◽

Quantitative Structure Property Relationship ◽

Property Relationship ◽

Structure Property Relationship

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A modified scaled variable reduced coordinate (SVRC)-quantitative structure property relationship (QSPR) model for predicting liquid viscosity of pure organic compounds

Korean Journal of Chemical Engineering ◽

10.1007/s11814-017-0173-3 ◽

2017 ◽

Vol 34 (10) ◽

pp. 2715-2724 ◽

Cited By ~ 1

Author(s):

Seongmin Lee ◽

Kiho Park ◽

Yunkyung Kwon ◽

Tae-Yun Park ◽

Dae Ryook Yang

Keyword(s):

Organic Compounds ◽

Liquid Viscosity ◽

Quantitative Structure ◽

Structure Property ◽

Qspr Model ◽

Quantitative Structure Property Relationship ◽

Property Relationship ◽

Structure Property Relationship

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Which structural features stand behind micelization of ionic liquids? Quantitative Structure-Property Relationship studies

Journal of Colloid and Interface Science ◽

10.1016/j.jcis.2016.10.066 ◽

2017 ◽

Vol 487 ◽

pp. 475-483 ◽

Cited By ~ 13

Author(s):

Maciej Barycki ◽

Anita Sosnowska ◽

Tomasz Puzyn

Keyword(s):

Ionic Liquids ◽

Structural Features ◽

Quantitative Structure ◽

Structure Property ◽

Quantitative Structure Property Relationship ◽

Property Relationship ◽

Structure Property Relationship

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Predicting the glass transition temperature of ionic liquids by the quantitative structure property relationship method using a topological index

Fluid Phase Equilibria ◽

10.1016/j.fluid.2013.08.021 ◽

2013 ◽

Vol 358 ◽

pp. 166-171 ◽

Cited By ~ 11

Author(s):

Fangyou Yan ◽

Shuqian Xia ◽

Qiang Wang ◽

Qiaoyan Shang ◽

Peisheng Ma

Keyword(s):

Ionic Liquids ◽

Glass Transition ◽

Transition Temperature ◽

Glass Transition Temperature ◽

Topological Index ◽

Quantitative Structure ◽

Structure Property ◽

Quantitative Structure Property Relationship ◽

Property Relationship ◽

Structure Property Relationship

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