Evidence map›Paper›PMID 41550905›Full record

ArticleACS materials Au2026

Molecular Modeling-Based Machine Learning for Accurate Prediction of Gas Diffusivity and Permeability in Metal-Organic Frameworks.

Pelin Sezgin, Feride Neva Yüngül, Beste Naz Karaca, Hasan Can Gulbalkan, Seda Keskin

Abstract read
In one paragraph

Article in ACS materials Au, 2026. 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. 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

5 authors.

Pelin SezginDepartment of Chemical and Biological Engineering, Koç University, Rumelifeneri Yolu, Sariyer, 34450 Istanbul, Turkey.
Feride Neva YüngülDepartment of Chemical and Biological Engineering, Koç University, Rumelifeneri Yolu, Sariyer, 34450 Istanbul, Turkey.
Beste Naz KaracaDepartment of Chemical and Biological Engineering, Koç University, Rumelifeneri Yolu, Sariyer, 34450 Istanbul, Turkey.
Hasan Can GulbalkanDepartment of Chemical and Biological Engineering, Koç University, Rumelifeneri Yolu, Sariyer, 34450 Istanbul, Turkey.ORCID https://orcid.org/0000-0001-8001-6018
Seda KeskinDepartment of Chemical and Biological Engineering, Koç University, Rumelifeneri Yolu, Sariyer, 34450 Istanbul, Turkey.ORCID https://orcid.org/0000-0001-5968-0336

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

Gas diffusion determines the performance of metal-organic frameworks (MOFs) in various practical applications, including membrane-based separations, yet its experimental measurement is challenging. We presented an efficient computational framework that integrates high-fidelity molecular dynamics (MD) simulations with machine learning (ML) to predict the diffusivities of CO

Indexed as

diffusiongas separationmachine learningmetal−organic frameworkmolecular simulation

Identifiers

PMID41550905
PMCPMC12810029

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.