Evidence map›Paper›PMID 41252349›Full record

ArticleChemphyschem : a European journal of chemical physics and physical chemistry2026

A Computational Study of a [2]Rotaxane Molecular Shuttle with All-Atoms Molecular Dynamics and Density Functional Theory Simulations in Solution.

Costantino Zazza, Nico Sanna, Stefano Borocci, Felice Grandinetti

Abstract read
In one paragraph

Article in Chemphyschem : a European journal of chemical physics and physical chemistry, 2026. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 3 papers.

0numbers the graph read from it
0cells of the map it votes in
3citing 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

3 citing papers in PubMed.

  1. Article
  2. Article
  3. 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

4 authors.

Costantino ZazzaDepartment for Innovation in Biological, Agro-food and Forest systems, Università della Tuscia (DIBAF), L.go dell'Università, s.n.c., 01100, Viterbo, Italy.ORCID https://orcid.org/0000-0002-9050-1874
Nico SannaDepartment for Innovation in Biological, Agro-food and Forest systems, Università della Tuscia (DIBAF), L.go dell'Università, s.n.c., 01100, Viterbo, Italy.ORCID https://orcid.org/0000-0002-1947-7939
Stefano BorocciDepartment for Innovation in Biological, Agro-food and Forest systems, Università della Tuscia (DIBAF), L.go dell'Università, s.n.c., 01100, Viterbo, Italy.ORCID https://orcid.org/0000-0003-4931-3019
Felice GrandinettiDepartment for Innovation in Biological, Agro-food and Forest systems, Università della Tuscia (DIBAF), L.go dell'Università, s.n.c., 01100, Viterbo, Italy.ORCID https://orcid.org/0000-0001-7217-9490

Funding

Rome Technopole foundation
6 · The paper itself

Abstract

A rigid H-shaped [2]rotaxane shuttle composed by a mechanically interlocked 24-crown-8(24C8) macrocycle on a thread containing two symmetrical benzimidazole (Bzi) stations bound with a central 2,2'-bipyridyl (Bipy) core is addressed in CH

Indexed as

density functional theoriesmolecular shuttlesnanoscale devicesquantum theory of atoms in molecules

Identifiers

PMID41252349
PMCPMC12810620

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.