pSSAlib

pSSAlib simulates stochastic chemical kinetics using partial-propensity algorithms to model probabilistic biochemical reaction dynamics and spatiotemporal reaction-diffusion processes.


Key Features:

  • Partial-Propensity Methods: Employs partial-propensity stochastic simulation algorithms to efficiently capture probabilistic reaction kinetics.
  • Model Import and Compatibility: Supports SBML models for integration with existing systems biology models.
  • Time Delays and Spatiotemporal Dynamics: Incorporates time delays and supports stochastic spatiotemporal reaction-diffusion systems.
  • Statistical Analysis Tools: Provides tools for statistical analysis of simulation results to aid interpretation.
  • Multiple Output Formats: Exports simulation data in multiple output formats for downstream analysis.
  • Developer API and Plug-ins: Includes a developer API, a command-line interface, and an SBMLToolbox plug-in for integrations.

Scientific Applications:

  • Endocytic Pathway Modeling: Models the endocytic pathway in eukaryotic cells and reveals a stochastic counterpart to the cut-out switch motif.

Methodology:

Simulations use partial-propensity stochastic simulation algorithms to simulate chemical kinetics, incorporating time delays and stochastic spatiotemporal reaction-diffusion dynamics.

Topics

Details

License:
LGPL-3.0
Maturity:
Mature
Cost:
Free of charge
Tool Type:
command-line tool
Operating Systems:
Linux, Mac
Programming Languages:
C++
Added:
6/25/2018
Last Updated:
11/25/2024

Operations

Data Inputs & Outputs

Molecular dynamics

Inputs

    Outputs

    Publications

    Ostrenko O, Incardona P, Ramaswamy R, Brusch L, Sbalzarini IF. pSSAlib: The partial-propensity stochastic chemical network simulator. PLOS Computational Biology. 2017;13(12):e1005865. doi:10.1371/journal.pcbi.1005865. PMID:29206229. PMCID:PMC5730222.

    PMID: 29206229
    PMCID: PMC5730222
    Funding: - Bundesministerium für Bildung und Forschung: 031A099, 031L033 - Alexander von Humboldt-Stiftung: Fellowship - Deutsche Forschungsgemeinschaft: EXC Center for Advancing Electronics Dresden

    Documentation

    Downloads