Toeholder: a software for automated design and in silico validation of toehold riboswitches

Autor: Angel F. Cisneros, Francois D. Rouleau, Carla Bautista, Pascale Lemieux, Nathan Dumont-Leblond
Jazyk: angličtina
Rok vydání: 2023
Předmět:
Zdroj: PeerJ Physical Chemistry, Vol 5, p e28 (2023)
Druh dokumentu: article
ISSN: 2689-7733
DOI: 10.7717/peerj-pchem.28
Popis: Synthetic biology aims to engineer biological circuits, which often involve gene expression. A particularly promising group of regulatory elements are riboswitches because of their versatility with respect to their targets, but early synthetic designs were not as attractive because of a reduced dynamic range with respect to protein regulators. Only recently, the creation of toehold switches helped overcome this obstacle by also providing an unprecedented degree of orthogonality. However, a lack of automated design and optimization tools prevents the widespread and effective use of toehold switches in high throughput experiments. To address this, we developed Toeholder, a comprehensive open-source software for toehold design and in silico comparison. Toeholder takes into consideration sequence constraints from experimentally tested switches, as well as data derived from molecular dynamics simulations of a toehold switch. We describe the software and its in silico validation results, as well as its potential applications and impacts on the management and design of toehold switches.
Databáze: Directory of Open Access Journals