Evidence map›Paper›PMID 38046342›Full record

ArticleACS omega2023

Efficiently Differentiating Agonists and Competitive Antagonists for Weak Allosteric Protein-Ligand Interactions with Linear Response Theory.

Anthony J Davolio, Wojciech J Jankowski, Csilla Várnai, Benedict W J Irwin, Michael C Payne, Pak-Lee Chau

Abstract read
In one paragraph

Article in ACS omega, 2023. 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
–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

0 citing papers in PubMed.

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

6 authors.

Anthony J DavolioTheory of Condensed Matter Group, Department of Physics, University of Cambridge, Cambridge CB3 0HE, U.K.ORCID https://orcid.org/0009-0003-4766-8817
Wojciech J JankowskiTheory of Condensed Matter Group, Department of Physics, University of Cambridge, Cambridge CB3 0HE, U.K.
Csilla VárnaiCentre for Computational Biology, University of Birmingham, Birmingham B15 2TT, U.K.ORCID https://orcid.org/0000-0003-0048-9507
Benedict W J IrwinTheory of Condensed Matter Group, Department of Physics, University of Cambridge, Cambridge CB3 0HE, U.K.
Michael C PayneTheory of Condensed Matter Group, Department of Physics, University of Cambridge, Cambridge CB3 0HE, U.K.
Pak-Lee ChauBioinformatique Structurale, Institut Pasteur, CNRS URA 3528, CB3I CNRS USR 3756, 75724 Paris, France.

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

What makes an agonist and a competitive antagonist? In this work, we aim to answer this question by performing parallel tempering Monte Carlo simulations on the serotonin type 3A (5-HT

Identifiers

PMID38046342
PMCPMC10688131

What OpenQuestion holds

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LicenceCC BY-NC-ND
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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.