Evidence map›Paper›PMID 39563810›Full record

ArticleACS medicinal chemistry letters2024

Machine Learning to Predict Potential Energy Surface of Resveratrol Drug: A Quantum-Level Calculation.

Hossein Shirani, Seyed Majid Hashemianzadeh

Abstract read
In one paragraph

Article in ACS medicinal chemistry letters, 2024. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 1 paper.

0numbers the graph read from it
0cells of the map it votes in
1citing 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

1 citing paper in PubMed.

  1. Review
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

2 authors.

Hossein ShiraniMolecular Simulation Research Laboratory, Department of Chemistry, Iran University of Science and Technology, Tehran 16846-13114, Iran.ORCID https://orcid.org/0000-0002-8740-7094
Seyed Majid HashemianzadehMolecular Simulation Research Laboratory, Department of Chemistry, Iran University of Science and Technology, Tehran 16846-13114, Iran.ORCID https://orcid.org/0000-0003-1480-9014

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

The ANI-1x neural network potential, trained on the density functional theory data set, as a quantum-level machine learning calculation has been investigated to forecast the potential energy surfaces of the Resveratrol (3,5,4'-trihydroxy-

Identifiers

PMID39563810
PMCPMC11571027

What OpenQuestion holds

Textmetadata
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.