Identification of biophysical interaction patterns in direct coupling analysis.


Journal

Physical review. E
ISSN: 2470-0053
Titre abrégé: Phys Rev E
Pays: United States
ID NLM: 101676019

Informations de publication

Date de publication:
Apr 2021
Historique:
received: 13 09 2020
accepted: 27 03 2021
entrez: 19 5 2021
pubmed: 20 5 2021
medline: 20 5 2021
Statut: ppublish

Résumé

Direct-coupling analysis is a statistical learning method for protein contact prediction based on sequence information alone. The maximum entropy principle leads to an effective inverse Potts model. Predictions on contacts are based on fitted local fields and couplings from an empirical multiple sequence alignment. Typically, the l_{2} norm of the resulting two-body couplings is used for contact prediction. However, this procedure discards important information. In this paper we show that the usage of the full fields and coupling information improves prediction accuracy.

Identifiants

pubmed: 34005861
doi: 10.1103/PhysRevE.103.042418
doi:

Types de publication

Journal Article

Langues

eng

Sous-ensembles de citation

IM

Pagination

042418

Auteurs

Michael Schmidt (M)

Department of Physics, TU Darmstadt, Karolinenpl. 5, 64289 Darmstadt, Germany.

Kay Hamacher (K)

Department of Physics, TU Darmstadt, Karolinenpl. 5, 64289 Darmstadt, Germany.
Department of Biology, TU Darmstadt, Schnittspahnstr. 10, 64287 Darmstadt, Germany.
Department of Computer Science, TU Darmstadt, Karolinenpl. 5, 64289 Darmstadt, Germany.

Classifications MeSH