Evidence map›Paper›PMID 32979094›Full record

ArticleJournal of molecular modeling2020

The hybrid models, containing hydrolytic and electron-driven processes, in theoretical study of oxaliplatin biotransformation.

Janina Kuduk-Jaworska, Jerzy J Jański, Szczepan Roszak

Open access · hybridAbstract read
PubMed Full text at PMC Publisher
In one paragraph

Article in Journal of molecular modeling, 2020. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Not yet cited in PubMed.

0numbers the graph read from it
0cells of the map it votes in
0citing papers in PubMed
0.1field-weighted citation impact, top 54% of its field
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

0 citing papers in PubMed, 1 citations in OpenAlex.

No citing paper in PubMed yet.

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

3 authors at 2 institutions in 2 countries.

Janina Kuduk-JaworskaFaculty of Chemistry, Wrocław University, F. Joliot-Curie 14, 50-370, Wrocław, Poland.
Jerzy J JańskiFaculty of Chemistry, Wrocław University, F. Joliot-Curie 14, 50-370, Wrocław, Poland.
Szczepan RoszakDepartment of Physical and Quantum Chemistry, Faculty of Chemistry, Wrocław University of Science and Technology, Wyb. Wyspiańskiego 27, 50-370, Wrocław, Poland. szczepan.roszak@pwr.edu.pl.ORCID https://orcid.org/0000-0002-3569-2321
University of Wrocław · PLWrocław University of Science and Technology · PL

Funding

NCN UMO-2013/09/B/ST4/00097
6 · The paper itself

Abstract

The results of theoretical simulations of reaction paths for oxaliplatin from pro-drug into its active form responsible for cytostatic effect are presented. The studies based on the quantum-chemical density functional theory approach were performed considering environmental influence resulting from the aquation or electron donation. The hybrid mechanisms: hydrolytic mixed with electron driven were found to be the energetically favourable.

Indexed as

Models, TheoreticalBiotransformationDensity Functional TheoryElectronsHydrolysisModels, MolecularMolecular ConformationMolecular StructureOxaliplatinOxaliplatinDFT calculationsElectron-driven reactionsHybrid mechanismNonclassical Pt-water interactionsOxaliplatin transformation

Identifiers

PMID32979094
PMCPMC7519906
OpenAlexW3088827584

What OpenQuestion holds

Textmetadata
LicenceCC BY
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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.