Influence of nanopore coating patterns on the translocation dynamics of polyelectrolytes

Author:

Datar Adwait12ORCID,Tanyhin Bohdan34ORCID,Melchionna Simone34ORCID,Fyta Maria15ORCID

Affiliation:

1. Institute for Computational Physics, Universität Stuttgart 1 , Allmandring 3, Stuttgart 70569, Germany

2. Institute of Data-Science Foundations, Hamburg University of Technology 2 , Hamburg 21073, Germany

3. IAC-CNR, Istituto per le Applicazioni del Calcolo “M. Picone,” 3 19 Via dei Taurini, Rome 00185, Italy

4. Lexma Technology LLC 4 , 20 School St., Belmont, Massachusetts 02478, USA

5. Computational Biotechnology, RWTH Aachen 5 , Worringerweg, Aachen 52074, Germany

Abstract

Polyelectrolytes can electrophoretically be driven through nanopores in order to be detected. The respective translocation events are often very fast and the process needs to be controlled to promote efficient detection. To this end, we attempt to control the translocation dynamics by coating the inner surface of a nanopore. For this, different charge distributions are chosen that result in substantial variations of the pore–polymer interactions. In addition and in view of the existing detection modalities, experimental settings, and nanopore materials, different types of sensors inside the nanopore have been considered to probe the translocation process and its temporal spread. The respective transport of polyelectrolytes through the coated nanopores is modeled through a multi-physics computational scheme that incorporates a mesoscopic/electrokinetic description for the solvent and particle-based scheme for the polymer. This investigation could underline the interplay between sensing modality, nanopore material, and detection accuracy. The electro-osmotic flow and electrophoretic motion in a pore are analyzed together with the polymeric temporal and spatial fluctuations unraveling their correlations and pathways to optimize the translocation speed and dynamics. Accordingly, this work sketches pathways in order to tune the pore–polymer interactions in order to control the translocation dynamics and, in the long run, errors in their measurements.

Funder

Deutsche Forschungsgemeinschaft

Ministerium für Wissenschaft, Forschung und Kunst Baden-Württemberg

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

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