Evidence map›Paper›PMID 39629167›Full record

ArticleStructural dynamics (Melville, N.Y.)2024

ProteinReDiff: Complex-based ligand-binding proteins redesign by equivariant diffusion-based generative models.

Viet Thanh Duy Nguyen, Nhan D Nguyen, Truong Son Hy

Abstract read
In one paragraph

Article in Structural dynamics (Melville, N.Y.), 2024. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 5 papers.

0numbers the graph read from it
0cells of the map it votes in
5citing 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

5 citing papers in PubMed.

  1. LINKER:Journal of chemical information and modeling · 2026
    Article
  2. Article
  3. Artificial intelligence in structural biology: Preface.Structural dynamics (Melville, N.Y.) · 2025
    Article
  4. Article
  5. 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

3 authors.

Viet Thanh Duy NguyenFPT Software AI Center, Ho Chi Minh City, Vietnam.ORCID https://orcid.org/0009-0001-8319-3033
Nhan D NguyenPritzker School of Molecular Engineering, University of Chicago, Chicago, Illinois 60637, USA.ORCID https://orcid.org/0000-0001-8854-0893
Truong Son HyDepartment of Computer Science, University of Alabama at Birmingham, Birmingham, Alabama 35294, USA.ORCID https://orcid.org/0000-0002-5092-3757

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

Proteins, serving as the fundamental architects of biological processes, interact with ligands to perform a myriad of functions essential for life. Designing functional ligand-binding proteins is pivotal for advancing drug development and enhancing therapeutic efficacy. In this study, we introduce ProteinReDiff, an diffusion framework targeting the redesign of ligand-binding proteins. Using equivariant diffusion-based generative models, ProteinReDiff enables the creation of high-affinity ligand-binding proteins without the need for detailed structural information, leveraging instead the potential of initial protein sequences and ligand SMILES strings. Our evaluations across sequence diversity, structural preservation, and ligand binding affinity underscore ProteinReDiff's potential to advance computational drug discovery and protein engineering.

Identifiers

PMID39629167
PMCPMC11614476

What OpenQuestion holds

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LicenceCC BY
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Registered trials

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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.