Evidence map›Paper›PMID 35099097›Full record

ArticleAngewandte Chemie (International ed. in English)2022

Hydrocarbon Macrocycle Conformer Ensembles and

Fabian Bohle, Stefan Grimme

Abstract read
In one paragraph

Article in Angewandte Chemie (International ed. in English), 2022. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 8 papers.

0numbers the graph read from it
0cells of the map it votes in
8citing 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

8 citing papers in PubMed.

  1. Article
  2. Article
  3. Article
  4. Article
  5. The unusual (Acta crystallographica. Section E, Crystallographic communications · 2023
    Article
  6. Article
  7. Optimization of the rThe journal of physical chemistry. A · 2022
    Article
  8. Hydrocarbon Macrocycle Conformer Ensembles andAngewandte Chemie (International ed. in English) · 2022
    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

2 authors.

Fabian BohleMulliken Center for Theoretical Chemistry, Rheinische Friedrich-Wilhelms-Universität Bonn, Beringstr. 4, 53115, Bonn, Germany.ORCID 0000-0003-2621-6339
Stefan GrimmeMulliken Center for Theoretical Chemistry, Rheinische Friedrich-Wilhelms-Universität Bonn, Beringstr. 4, 53115, Bonn, Germany.ORCID 0000-0002-5844-4371

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

NMR as a routine analytical method provides important three-dimensional structure information of compounds in solution. Here we apply the recently released CRENSO computational workflow for the automated generation of conformer ensembles to the quantum mechanical calculation of

Indexed as

HydrocarbonsMagnetic Resonance ImagingMagnetic Resonance SpectroscopyMolecular ConformationQuantum TheoryHydrocarbonsComputational ChemistryMacrocycleNMR-SpectroscopyStructure Elucidation

Identifiers

PMID35099097
PMCPMC9303527

What OpenQuestion holds

Textmetadata
LicenceCC BY-NC
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.