rrQNet

rrQNet estimates the quality of predicted protein contact maps using deep learning applied directly to two-dimensional residue–residue contact matrices.


Key Features:

  • Evolutionary Reconciliation Network: Utilizes cascaded deep neural network modules to encode evolutionary context and perform reconciliation between predicted contacts and evolutionary signals.
  • Residue-Pair Level Scoring: Generates quality scores for individual residue pairs and aggregates them to produce overall contact map quality estimates, enabling multi-resolution assessment.

Scientific Applications:

  • Protein Structure Prediction Assessment: Evaluates and ranks predicted contact maps to support validation and refinement of computational protein structure models.

Methodology:

rrQNet applies a deep neural network architecture trained on diverse contact predictors to assess consistency between predicted residue–residue contacts and evolutionary information, producing quantitative quality scores for contact maps.

Topics

Details

License:
GPL-3.0
Cost:
Free of charge
Tool Type:
command-line tool
Operating Systems:
Mac, Linux, Windows
Programming Languages:
Python
Added:
9/17/2022
Last Updated:
11/24/2024

Operations

Publications

Roche R, Bhattacharya S, Shuvo MH, Bhattacharya D. <scp>rrQNet</scp> : Protein contact map quality estimation by deep evolutionary reconciliation. Proteins: Structure, Function, and Bioinformatics. 2022;90(12):2023-2034. doi:10.1002/prot.26394. PMID:35751651. PMCID:PMC9633355.

PMID: 35751651
PMCID: PMC9633355
Funding: - National Institute of General Medical Sciences: R35GM138146 - National Science Foundation of Sri Lanka: DBI‐1942692, IIS‐2030722