Modelling ion channels with a view towards identifiability

Fuente: arXiv
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Main Author: Siekmann, Ivo
Format: Preprint
Published: 2025
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author Siekmann, Ivo
author_facet Siekmann, Ivo
contents Aggregated Markov models provide a flexible framework for stochastic dynamics that develops on multiple timescales. For example, Markov models for ion channels often consist of multiple open and closed state to account for "slow" and "fast" openings and closings of the channel. The approach is a popular tool in the construction of mechanistic models of ion channels - instead of viewing model states as generators of sojourn times of a certain characteristic length, each individual model state is interpreted as a representation of a distinct biophysical state. We will review the properties of aggregated Markov models and discuss the implications for mechanistic modelling. First, we show how the aggregated Markov models with a given number of states can be calculated using Pólya enumeration However, models with $n_O$ open and $n_C$ closed states that exceed the maximum number $2 n_O n_C$ of parameters are non-identifiable. We will present two derivations for this classical result and investigate non-identifiability further via a detailed analysis of the non-identifiable fully connected three-state model. Finally, we will discuss the implications of non-identifiability for mechanistic modelling of ion channels. We will argue that instead of designing models based on assumed transitions between distinct biophysical states which are modulated by ligand binding, it is preferable to build models based on additional sources of data that give more direct insight into the dynamics of conformational changes.
format Preprint
id arxiv_https___arxiv_org_abs_2510_26728
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle Modelling ion channels with a view towards identifiability
Siekmann, Ivo
Biomolecules
92C05 (Primary) 60J28, 05C30 (Secondary)
Aggregated Markov models provide a flexible framework for stochastic dynamics that develops on multiple timescales. For example, Markov models for ion channels often consist of multiple open and closed state to account for "slow" and "fast" openings and closings of the channel. The approach is a popular tool in the construction of mechanistic models of ion channels - instead of viewing model states as generators of sojourn times of a certain characteristic length, each individual model state is interpreted as a representation of a distinct biophysical state. We will review the properties of aggregated Markov models and discuss the implications for mechanistic modelling. First, we show how the aggregated Markov models with a given number of states can be calculated using Pólya enumeration However, models with $n_O$ open and $n_C$ closed states that exceed the maximum number $2 n_O n_C$ of parameters are non-identifiable. We will present two derivations for this classical result and investigate non-identifiability further via a detailed analysis of the non-identifiable fully connected three-state model. Finally, we will discuss the implications of non-identifiability for mechanistic modelling of ion channels. We will argue that instead of designing models based on assumed transitions between distinct biophysical states which are modulated by ligand binding, it is preferable to build models based on additional sources of data that give more direct insight into the dynamics of conformational changes.
title Modelling ion channels with a view towards identifiability
topic Biomolecules
92C05 (Primary) 60J28, 05C30 (Secondary)
url https://arxiv.org/abs/2510.26728