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q-bio.MNJul 31, 2020
authors
  • Peter J. Gawthrop
institutions
  • The University of Melbourne
arXiv abstractPDF
paper

Bond Graphs Unify Stoichiometric Analysis and Thermodynamics

arXiv:2007.15917

Abstract

Whole-cell modelling is constrained by the laws of nature in general and the laws of thermodynamics in particular. This paper shows how one prolific source of information, stoichiometric models of biomolecular systems, can be integrated with thermodynamic principles using the bond graph approach to network thermodynamics.

References in corpus (11)

  • Irreversible thermodynamics of open chemical networks I: Emergent cycles and broken conservation laws
  • Emerging whole-cell modeling principles and methods
  • Energy-based Analysis of Biochemical Cycles using Bond Graphs
  • Hierarchical Bond Graph Modelling of Biochemical Networks
  • Bond Graph Modelling of Chemoelectrical Energy Transduction
  • Physically-Plausible Modelling of Biomolecular Systems: A Simplified, Energy-Based Model of the Mitochondrial Electron Transport Chain
  • Removing both Internal and Unrealistic Energy-Generating Cycles in Flux Balance Analysis
  • The cardiac Na+/K+ ATPase: An updated, thermodynamically consistent model
  • Computer-aided modelling of complex physical systems with BondGraphTools
  • Biomolecular System Energetics
  • Computing Biomolecular System Steady-states
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