ArticleChemical science2024
Article in Chemical science, 2024. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 6 papers.
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.
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.
Who cites it
6 citing papers in PubMed.
- Cartesian equivariant representations for learning and understanding molecular orbitals.Proceedings of the National Academy of Sciences of the United States of America · 2025Article
- Graph-based prediction of reaction barrier heights with on-the-fly prediction of transition states.Digital discovery · 2025Article
- A Deep Learning-Augmented Density Functional Framework for Reaction Modeling with Chemical Accuracy.JACS Au · 2025Article
- Representing Born effective charges with equivariant graph convolutional neural networks.Scientific reports · 2025Article
- Enhancing Activation Energy Predictions under Data Constraints Using Graph Neural Networks.Journal of chemical information and modeling · 2025Article
- 3DReact: Geometric Deep Learning for Chemical Reactions.Journal of chemical information and modeling · 2024Article
Corrections and comments
PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.
Authors and funding
6 authors.
Funding
No grant is acknowledged in the PubMed record.
Abstract
Activation barriers of elementary reactions are essential to predict molecular reaction mechanisms and kinetics. However, computing these energy barriers by identifying transition states with electronic structure methods (
Identifiers
What OpenQuestion holds
Registered trials
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.