Evidence map›Paper›PMID 39902622›Full record

ArticleProteins2025

Performance of Hybrid Strategies Combining MDockPP and AlphaFold2 in CAPRI Rounds 47-55.

Rui Duan, Xianjin Xu, Liming Qiu, Shuang Zhang, Xiaoqin Zou

Abstract read
In one paragraph

Article in Proteins, 2025. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Not yet cited in PubMed.

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

0 citing papers in PubMed.

No citing paper in PubMed yet.

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

5 authors.

Rui DuanDalton Cardiovascular Research Center, University of Missouri, Columbia, USA.
Xianjin XuDalton Cardiovascular Research Center, University of Missouri, Columbia, USA.
Liming QiuDalton Cardiovascular Research Center, University of Missouri, Columbia, USA.
Shuang ZhangDalton Cardiovascular Research Center, University of Missouri, Columbia, USA.
Xiaoqin ZouDalton Cardiovascular Research Center, University of Missouri, Columbia, USA.ORCID https://orcid.org/0000-0003-0637-8648

Funding

Structure prediction and in silico screening of protein-peptide interactionsR35GM136409 · NIGMS · UNIVERSITY OF MISSOURI-COLUMBIA · PI XIAOQIN ZOU · 2020 to 2026
$2.9M
A full spectrum rational approach to identify antiarrhythmic agents targeting IKs ChannelsR01HL166628 · NHLBI · STATE UNIVERSITY NEW YORK STONY BROOK · PI Jianmin Cui, RICHARD Z LIN · 2023 to 2026
$2.8M
NHLBI NIH HHS R01 HL166628NIGMS NIH HHS R35 GM136409NIH HHS
6 · The paper itself

Abstract

CAPRI challenges offer a range of blind tests for biomolecule interaction prediction. This study evaluates the performance of our prediction protocols for the human group Zou and the server group MDockPP in CAPRI rounds 47-55, highlighting the impact of AlphaFold2 (AF2) and the effectiveness of massive sampling approaches. Prior to AlphaFold2's release, our methods relied on homology modeling and docking-based protocols, achieving limited accuracy due to constraints in structural templates and inherent docking limitations. After AlphaFold2's public release, which demonstrated breakthrough accuracy in protein structure prediction, we integrated its multimer models and massive sampling techniques into our protocols. This integration significantly improved prediction accuracy, with human predictions increasing from 1 correct interface of 19 pre-AlphaFold2 to 4 of 8 post-AlphaFold2. The massive sampling approach further enhanced performance, particularly for targets T231 and T233, yielding medium-quality models that default parameters could not achieve.

Indexed as

molecular dockingprotein–DNA interactionsprotein–peptide interactionsprotein–protein interactionsscoring function

Identifiers

PMID39902622
PMCPMC12319115

What Socratic 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 Socratic graph.