Evidence map›Paper›PMID 32012780›Full record

ArticleBiomolecules2020

Reactivation of VX-Inhibited Human Acetylcholinesterase by Deprotonated Pralidoxime. A Complementary Quantum Mechanical Study.

Jorge Alberto Valle da Silva, Ander Francisco Pereira, Steven R LaPlante, Kamil Kuca, Teodorico Castro Ramalho, Tanos Celmar Costa França

Open access · goldAbstract read
In one paragraph

Article in Biomolecules, 2020. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 6 papers.

0numbers the graph read from it
0cells of the map it votes in
6citing papers in PubMed
2.3field-weighted citation impact, top 12% 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

6 citing papers in PubMed, 14 citations in OpenAlex.

  1. Article
  2. Article
  3. Article
  4. Review
  5. Article
  6. Understanding the Interaction Modes and Reactivity of Trimedoxime towardInternational journal of molecular sciences · 2020
    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

6 authors at 3 institutions in 3 countries.

Jorge Alberto Valle da SilvaChemical, Biological, Radiological and Nuclear Defense Institute, Avenida das Americas, 28705, Guaratiba, 23020-470 Rio de Janeiro/RJ, Brazil.
Ander Francisco PereiraLaboratory of Molecular Modeling, Chemistry Department, Federal University of Lavras, 37200-000 Lavras, MG, Brazil.
Steven R LaPlanteINRS-Centre Armand-Frapier Santé Biotechnologie, 531 boulevard des Prairies, Laval, QC H7V 1B7, Canada.
Kamil KucaDepartment of Chemistry, Faculty of Science, University of Hradec Kralove, Rokitanskeho 62, 50003 Hradec Kralove, Czech Republic.
Teodorico Castro RamalhoLaboratory of Molecular Modeling, Chemistry Department, Federal University of Lavras, 37200-000 Lavras, MG, Brazil.
Tanos Celmar Costa FrançaINRS-Centre Armand-Frapier Santé Biotechnologie, 531 boulevard des Prairies, Laval, QC H7V 1B7, Canada.
Institut National de la Recherche Scientifique · CAUniversidade Federal de Lavras · BRUniversity of Hradec Králové · CZ

Funding

CAPES, CNPq 308225/2018-0FAPEMIG and FAPERJ E-02/202.961/2017
6 · The paper itself

Abstract

In the present work, we performed a complementary quantum mechanical (QM) study to describe the mechanism by which deprotonated pralidoxime (2-PAM) could reactivate human (

Indexed as

AcetylcholinesteraseCatalytic DomainHumansMolecular ConformationMolecular Dynamics SimulationOrganothiophosphorus CompoundsPralidoxime CompoundsProtonsQuantum TheorySerineAcetylcholinesteraseOrganothiophosphorus CompoundspralidoximePralidoxime CompoundsProtonsSerineVX-agent2-PAMacetylcholinesteraseQM/MM methodVX

Identifiers

PMID32012780
PMCPMC7072650
OpenAlexW3002928708

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.