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ZENODO
Dataset . 2024
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ZENODO
Dataset . 2024
License: CC BY
Data sources: ZENODO
ZENODO
Dataset . 2024
License: CC BY
Data sources: Datacite
ZENODO
Dataset . 2024
License: CC BY
Data sources: Datacite
ZENODO
Dataset . 2024
License: CC BY
Data sources: Datacite
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Claim

Investigating the properties of fatty acid-based ionic liquids: Advancement in AMOEBA force field

Research datakeyboard_double_arrow_right Dataset 01 Jan 2024Publisher:Zenodo
Authors: Heidari, Sahar; Torabifard, Hedieh;

doi: 10.5281/zenodo.11088569 , 10.5281/zenodo.13362550 , 10.5281/zenodo.11088568

Investigating the properties of fatty acid-based ionic liquids: Advancement in AMOEBA force field

Abstract

Input, parameter and initial structure files for All Atom Molecular Dynamics simulations performed to validate the newly developed parameters and predict the properties of FA-IL systems are available in zip file.

This work was supported by the donors of ACS Petroleum Research Fund under Doctoral New Investigator Grant 66715-DNI6. H.T. served as Principal Investigator on ACS PRF 66715-DNI6 that provided support for S.H.

Related Organizations
Keywords

Molecular Dynamics, Bio-based Ionic Liquids, Force Field Development

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    popularity
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    influence
    This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
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    impulse
    This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
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selected citations
These citations are derived from selected sources.
This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Citations provided by BIP!
popularity
This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
BIP!Popularity provided by BIP!
influence
This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Influence provided by BIP!
impulse
This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
BIP!Impulse provided by BIP!
0
Average
Average
Average