Evidence map›Paper›PMID 38607955›Full record

ArticleChemistryOpen2024

Hydrodesulfurization of Dibenzothiophene: A Machine Learning Approach.

Guadalupe Castro, Julián Cruz-Borbolla, Marcelo Galván, Alfredo Guevara-García, Joel Ireta, Myrna H Matus, Amilcar Meneses-Viveros, Luis Ignacio Perea-Ramírez, Miriam Pescador-Rojas

Abstract read
In one paragraph

Article in ChemistryOpen, 2024. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 2 papers.

0numbers the graph read from it
0cells of the map it votes in
2citing papers in PubMed
–field-weighted citation impact
1 · What the graph read from it

What it found

Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.

The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.

2 · The registry

The trial behind it

Trials whose registry record cites this paper, or whose number appears in the abstract. A trial that started after this paper was published is citing it as background, not reporting it.

Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.

3 · Its place in the literature

Who cites it

2 citing papers in PubMed.

  1. Article
  2. Article
4 · The record

Corrections and comments

PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.

5 · Who and what money

Authors and funding

9 authors.

Guadalupe CastroDepartamento de Química, Universidad Autónoma Metropolitana-Iztapalapa, Av. Ferrocarril San Rafael Atlixco 186, Col. Leyes de Reforma 1 A Sección, Iztapalapa, C.P. 09310, Ciudad de México, México.ORCID https://orcid.org/0000-0002-9033-9168
Julián Cruz-BorbollaÁrea Académica de Química, Centro de Investigaciones Químicas - Universidad Autónoma del Estado de Hidalgo, Carretera Pachuca-Tulancingo km. 4.5, Ciudad del Conocimiento, C.P. 42184, Mineral de la Reforma, Hidalgo, México.ORCID https://orcid.org/0000-0002-1218-3719
Marcelo GalvánDepartamento de Química, Universidad Autónoma Metropolitana-Iztapalapa, Av. Ferrocarril San Rafael Atlixco 186, Col. Leyes de Reforma 1 A Sección, Iztapalapa, C.P. 09310, Ciudad de México, México.ORCID https://orcid.org/0000-0002-8898-749X
Alfredo Guevara-GarcíaDepartamento de Química, CONAHCYT-Universidad Autónoma Metropolitana-Iztapalapa, Av. Ferrocarril San Rafael Atlixco 186, Col. Leyes de Reforma 1 A Sección, Iztapalapa, C.P. 09310, Ciudad de México, México.ORCID https://orcid.org/0000-0002-1466-1817
Joel IretaDepartamento de Química, Universidad Autónoma Metropolitana-Iztapalapa, Av. Ferrocarril San Rafael Atlixco 186, Col. Leyes de Reforma 1 A Sección, Iztapalapa, C.P. 09310, Ciudad de México, México.ORCID https://orcid.org/0000-0001-7388-2524
Myrna H MatusInstituto de Química Aplicada, Universidad Veracruzana, Av. Luis Castelazo Ayala s/n, Col. Industrial-Ánimas, A.P. 575, Xalapa, Ver., México.ORCID https://orcid.org/0000-0003-2538-7400
Amilcar Meneses-ViverosDepartamento de Computación, CINVESTAV-IPN, Av. IPN 2508, Col. San Pedro Zacatenco, C.P. 07360, Ciudad de Mexico, México.ORCID https://orcid.org/0000-0003-1976-6199
Luis Ignacio Perea-RamírezInstituto de Química Aplicada, Universidad Veracruzana, Av. Luis Castelazo Ayala s/n, Col. Industrial-Ánimas, A.P. 575, Xalapa, Ver., México.ORCID https://orcid.org/0000-0002-0736-0936
Miriam Pescador-RojasEscuela Superior de Cómputo, Instituto Politécnico Nacional, Instituto Politécnico Nacional, Av. Juan de Dios Bátiz s/n, esq. Av. Miguel Othón de Mendizabal, Col. Lindavista, Gustavo A. Madero, C. P. 07738, Ciudad de México, México.ORCID https://orcid.org/0000-0001-7444-6740

Funding

CONAHCYT 2607570
6 · The paper itself

Abstract

The hydrodesulfurization (HDS) process is widely used in the industry to eliminate sulfur compounds from fuels. However, removing dibenzothiophene (DBT) and its derivatives is a challenge. Here, the key aspects that affect the efficiency of catalysts in the HDS of DBT were investigated using machine learning (ML) algorithms. The conversion of DBT and selectivity was estimated by applying Lasso, Ridge, and Random Forest regression techniques. For the estimation of conversion of DBT, Random Forest and Lasso offer adequate predictions. At the same time, regularized regressions have similar outcomes, which are suitable for selectivity estimations. According to the regression coefficient, the structural parameters are essential predictors for selectivity, highlighting the pore size, and slab length. These properties can connect with aspects like the availability of active sites. The insights gained through ML techniques about the HDS catalysts agree with the interpretations of previous experimental reports.

Indexed as

Computational chemistryHeterogeneous catalysisHydrodesulfurizationLasso regressionSelectivity HYD/DDS

Identifiers

PMID38607955
PMCPMC11633359

What OpenQuestion holds

Textmetadata
LicenceCC BY
Read underepoch 390

Registered trials

None linked

Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.