Evidence map›Paper›PMID 39733341›Full record

ArticleThe journal of physical chemistry. B2025

Active Site Studies to Explain Kinetics of Lipas`s in Organic Solvents Using Molecular Dynamics Simulations.

Helena D Tjørnelund, Jesper Brask, John M Woodley, Günther H J Peters

Abstract read
In one paragraph

Article in The journal of physical chemistry. B, 2025. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 4 papers.

0numbers the graph read from it
0cells of the map it votes in
4citing 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

4 citing papers in PubMed.

  1. Article
  2. Changes in Water Dynamics by Osmolytes Regulate Enzyme Activity.The journal of physical chemistry. B · 2026
    Article
  3. Article
  4. 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.

Helena D TjørnelundDepartment of Chemistry, Technical University of Denmark, 2800 Kgs. Lyngby, Denmark.ORCID 0000-0001-8648-3266
Jesper BraskNovonesis A/S, 2800 Kgs. Lyngby, Denmark.
John M WoodleyDepartment of Chemical and Biochemical Engineering, Technical University of Denmark, 2800 Kgs. Lyngby, Denmark.ORCID 0000-0002-7976-2483
Günther H J PetersDepartment of Chemistry, Technical University of Denmark, 2800 Kgs. Lyngby, Denmark.ORCID 0000-0001-9754-2663

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

This study investigates the intricate dynamics underlying lipase performance in organic solvents using comprehensive molecular dynamics (MD) simulations, supported by enzyme kinetics data. The study reveals that a single criterion can neither predict nor explain lipase activity in organic solvents, indicating the need for a comprehensive approach. Three lipases were included in this study:

Indexed as

Catalytic DomainFungal ProteinsLipaseMolecular Dynamics SimulationRhizomucorSolventsAcetonitrilesEurotialesHexanesKineticsMethyl EthersWateracetonitrileAcetonitrilesFungal ProteinsHexanesLipaselipase B, Candida antarcticaMethyl Ethersmethyl tert-butyl etherSolventsWater

Identifiers

PMID39733341
PMCPMC11726617

What OpenQuestion holds

Textmetadata
LicenceCC BY-NC-ND
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.