Evidence map›Paper›PMID 38065235›Full record

ReviewBiochimica et biophysica acta. General subjects2024

Biomolecular dynamics in the 21st century.

Charles L Brooks, Alexander D MacKerell, Carol B Post, Lennart Nilsson

Abstract readReview
In one paragraph

Review in Biochimica et biophysica acta. General subjects, 2024. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 12 papers.

0numbers the graph read from it
0cells of the map it votes in
12citing 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

12 citing papers in PubMed.

  1. Article
  2. Article
  3. Article
  4. Article
  5. Review
  6. Article
  7. GRAMMCell: Docking-based Cell Modeling Resource.Journal of molecular biology · 2025
    Article
  8. Article
  9. Article
  10. Article
  11. Review
  12. 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.

Charles L BrooksUniversity of Michigan, Department of Chemistry, Ann Arbor, MI 48109, USA. Electronic address: brookscl@umich.edu.
Alexander D MacKerellUniversity of Maryland, School of Pharmacy, Baltimore, MD 21201, USA. Electronic address: amackere@rx.umaryland.edu.
Carol B PostPurdue University, Department of Medicinal Chemistry and Molecular Pharmacology, West Lafayette, IN 47907-2091, USA. Electronic address: cbp@purdue.edu.
Lennart NilssonKarolinska Institutet, Department of Biosciences and Nutrition, SE-14183 Huddinge, Sweden. Electronic address: Lennart.Nilsson@ki.se.

Funding

Theory and Modeling of Biomolecules and their Interactions - Equipment SupplementR35GM130587 · NIGMS · UNIVERSITY OF MICHIGAN AT ANN ARBOR · PI CHARLES L BROOKS · 2019 to 2026
$6.9M
NMR Structure of Peptide and Protein Complexes SupplementR01GM039478 · NIGMS · PURDUE UNIVERSITY WEST LAFAYETTE · PI POST, CAROL B. · 1997 to 2024
$6.5M
Macromolecular Conformational HeterogeneityR35GM131710 · NIGMS · UNIVERSITY OF MARYLAND BALTIMORE · PI ALEXANDER D MACKERELL · 2019 to 2026
$6.2M
Computational infrastructure for biomedically-driven simulation and modelingS10OD034346 · OD · UNIVERSITY OF MICHIGAN AT ANN ARBOR · PI BROOKS, CHARLES L · 2023 to 2023
$593k
NIGMS NIH HHS R01 GM039478NIGMS NIH HHS R35 GM130587NIGMS NIH HHS R35 GM131710NIH HHS S10 OD034346
6 · The paper itself

Abstract

The relevance of motions in biological macromolecules has been clear since the early structural analyses of proteins by X-ray crystallography. Computer simulations have been applied to provide a deeper understanding of the dynamics of biological macromolecules since 1976, and are now a standard tool in many labs working on the structure and function of biomolecules. In this mini-review we highlight some areas of current interest and active development for simulations, in particular all-atom molecular dynamics simulations.

Indexed as

Molecular Dynamics SimulationProteinsCrystallography, X-RayProteinsForce fieldSamplingSimulation

Identifiers

PMID38065235
PMCPMC10842176

What OpenQuestion holds

Textmetadata
LicenceTDM
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.