Personal information

Computational biophysics, Enzyme activity in aqueous ionic liquid solutions, Enzyme Inhibitors
Chile

Activities

Employment (1)

Universidad de Talca: Talca, CL

2023-01-01 to present | Research Associate (Instituto de Investigación Interdisciplinaria )
Employment
Source: Self-asserted source
M.S. Sadeghi Googheri

Works (10)

Combined experimental and computational studies of N-Phenyl-o-benzenedisulfonimide: Spectroscopy, DFT calculations, and Druggability analysis

Journal of Molecular Structure
2025-04 | Journal article
Contributors: Sedat Gumus; Mohammad Sadegh Sadeghi Googheri; Ahmet Gokhan Kazan; Bilge Eren
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Molecular insights into the influence of phosphonium-based ionic liquids (PhILs) on Burkholderia cepacia lipase (BCL) enzyme dynamics

Journal of Molecular Liquids
2025-01 | Journal article
Part of ISSN: 0167-7322
Contributors: Mohammad Sadegh Sadeghi Googheri; Jans Alzate-Morales; Sedat Gumus
Source: Self-asserted source
M.S. Sadeghi Googheri

Dummy Template Molecularly Imprinted Polymers for Electrochemical Detection of Cardiac Troponin I: A Combined Computational and Experimental Approach

Chemosensors
2025-01-20 | Journal article
Contributors: Mohammad Sadegh Sadeghi Googheri; Davide Campagnol; Paolo Ugo; Samira Hozhabr Araghi; Najmeh Karimian
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Crossref
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Preferred source (of 2)‎

Solvation behavior of phenolic pollutants in aqueous solutions of imidazolium-based ionic liquids: A molecular dynamics simulations study

Computational and Theoretical Chemistry
2023-10 | Journal article
Part of ISSN: 2210-271X
Contributors: Maryam Sadeghi Gougheri; Hasti Hashemi Nejad; Motahare Sadeghi Googheri; Mohammad Sadegh Sadeghi Googheri
Source: Self-asserted source
M.S. Sadeghi Googheri

An in-silico study to gain a comprehensive understanding of the effects of glucosylation on quercetin properties

Computational and Theoretical Chemistry
2023-02 | Journal article
Part of ISSN: 2210-271X
Contributors: Samira Hozhabr Araghi; John Amalraj; Motahare Sadeghi Googheri; Radha D. Pyarasani; Mohammad Sadegh Sadeghi Googheri
Source: Self-asserted source
M.S. Sadeghi Googheri

A molecular dynamics simulations study of the ionic liquid effect on the β-glucosidase active site interactions with a flavonoid glycoside

Journal of Molecular Liquids
2021-10 | Journal article
Part of ISSN: 0167-7322
Contributors: Samira Hozhabr Araghi; Amalraj John; Mohammad Sadegh Sadeghi Googheri
Source: Self-asserted source
M.S. Sadeghi Googheri

How a crosslinker agent interacts with the β-glucosidase enzyme surface in an aqueous solution: Insight from quantum mechanics calculations and molecular dynamics simulations

Colloids and Surfaces B: Biointerfaces
2021-07 | Journal article
Contributors: Samira Hozhabr Araghi; Amalraj John; Mohammad Sadegh Sadeghi Googheri
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Crossref

How cationic and anionic portions of an imidazolium-based ionic liquid interact with molecular liquids: Insights from density functional theory calculations

Journal of Molecular Liquids
2019-03 | Journal article
Part of ISSN: 0167-7322
Contributors: Amin Hosseinian; Mohammad Sadegh Sadeghi Googheri
Source: Self-asserted source
M.S. Sadeghi Googheri

Configurational effect on ion-pair interaction energies and intermolecular potential energy functions in imidazolium-based ionic liquids: A theoretical study

Journal of Molecular Liquids
2018-08 | Journal article
Part of ISSN: 0167-7322
Contributors: Motahare Sadeghi Googheri; Mohammad Sadegh Sadeghi Googheri; Samira Hozhabr Araghi
Source: Self-asserted source
M.S. Sadeghi Googheri

The effects of fluorine substitution on the chemical properties and inhibitory capacity of Donepezil anti-Alzheimer drug; density functional theory and molecular docking calculations

Journal of Molecular Graphics and Modelling
2017-01 | Journal article
Part of ISSN: 1093-3263
Contributors: Azita Khosravan; Safora Marani; Mohammad Sadegh Sadeghi Googheri
Source: Self-asserted source
M.S. Sadeghi Googheri