Literature DB >> 33497393

PEtab-Interoperable specification of parameter estimation problems in systems biology.

Leonard Schmiester1,2, Yannik Schälte1,2, Frank T Bergmann3, Tacio Camba4,5, Erika Dudkin6, Janine Egert7,8, Fabian Fröhlich9, Lara Fuhrmann6, Adrian L Hauber8,10, Svenja Kemmer8,10, Polina Lakrisenko1,2, Carolin Loos1,2,11,12, Simon Merkt6, Wolfgang Müller13, Dilan Pathirana6, Elba Raimúndez1,2,6, Lukas Refisch7,8, Marcus Rosenblatt8,10, Paul L Stapor1,2, Philipp Städter1,2, Dantong Wang1,2, Franz-Georg Wieland8,10, Julio R Banga5, Jens Timmer8,10,14, Alejandro F Villaverde5, Sven Sahle3, Clemens Kreutz7,8,14, Jan Hasenauer1,2,6, Daniel Weindl1.   

Abstract

Reproducibility and reusability of the results of data-based modeling studies are essential. Yet, there has been-so far-no broadly supported format for the specification of parameter estimation problems in systems biology. Here, we introduce PEtab, a format which facilitates the specification of parameter estimation problems using Systems Biology Markup Language (SBML) models and a set of tab-separated value files describing the observation model and experimental data as well as parameters to be estimated. We already implemented PEtab support into eight well-established model simulation and parameter estimation toolboxes with hundreds of users in total. We provide a Python library for validation and modification of a PEtab problem and currently 20 example parameter estimation problems based on recent studies.

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Year:  2021        PMID: 33497393      PMCID: PMC7864467          DOI: 10.1371/journal.pcbi.1008646

Source DB:  PubMed          Journal:  PLoS Comput Biol        ISSN: 1553-734X            Impact factor:   4.475


  22 in total

1.  COPASI--a COmplex PAthway SImulator.

Authors:  Stefan Hoops; Sven Sahle; Ralph Gauges; Christine Lee; Jürgen Pahle; Natalia Simus; Mudita Singhal; Liang Xu; Pedro Mendes; Ursula Kummer
Journal:  Bioinformatics       Date:  2006-10-10       Impact factor: 6.937

2.  Antimony: a modular model definition language.

Authors:  Lucian P Smith; Frank T Bergmann; Deepak Chandran; Herbert M Sauro
Journal:  Bioinformatics       Date:  2009-07-03       Impact factor: 6.937

3.  SBRML: a markup language for associating systems biology data with models.

Authors:  Joseph O Dada; Irena Spasić; Norman W Paton; Pedro Mendes
Journal:  Bioinformatics       Date:  2010-02-21       Impact factor: 6.937

4.  BioNetGen 2.2: advances in rule-based modeling.

Authors:  Leonard A Harris; Justin S Hogg; José-Juan Tapia; John A P Sekar; Sanjana Gupta; Ilya Korsunsky; Arshi Arora; Dipak Barua; Robert P Sheehan; James R Faeder
Journal:  Bioinformatics       Date:  2016-07-08       Impact factor: 6.937

5.  pyABC: distributed, likelihood-free inference.

Authors:  Emmanuel Klinger; Dennis Rickert; Jan Hasenauer
Journal:  Bioinformatics       Date:  2018-10-15       Impact factor: 6.937

6.  AMIGO, a toolbox for advanced model identification in systems biology using global optimization.

Authors:  Eva Balsa-Canto; Julio R Banga
Journal:  Bioinformatics       Date:  2011-06-17       Impact factor: 6.937

7.  Reproducible computational biology experiments with SED-ML--the Simulation Experiment Description Markup Language.

Authors:  Dagmar Waltemath; Richard Adams; Frank T Bergmann; Michael Hucka; Fedor Kolpakov; Andrew K Miller; Ion I Moraru; David Nickerson; Sven Sahle; Jacky L Snoep; Nicolas Le Novère
Journal:  BMC Syst Biol       Date:  2011-12-15

8.  SBtab: a flexible table format for data exchange in systems biology.

Authors:  Timo Lubitz; Jens Hahn; Frank T Bergmann; Elad Noor; Edda Klipp; Wolfram Liebermeister
Journal:  Bioinformatics       Date:  2016-04-08       Impact factor: 6.937

9.  COMBINE archive and OMEX format: one file to share all information to reproduce a modeling project.

Authors:  Frank T Bergmann; Richard Adams; Stuart Moodie; Jonathan Cooper; Mihai Glont; Martin Golebiewski; Michael Hucka; Camille Laibe; Andrew K Miller; David P Nickerson; Brett G Olivier; Nicolas Rodriguez; Herbert M Sauro; Martin Scharm; Stian Soiland-Reyes; Dagmar Waltemath; Florent Yvon; Nicolas Le Novère
Journal:  BMC Bioinformatics       Date:  2014-12-14       Impact factor: 3.169

10.  PyBioNetFit and the Biological Property Specification Language.

Authors:  Eshan D Mitra; Ryan Suderman; Joshua Colvin; Alexander Ionkov; Andrew Hu; Herbert M Sauro; Richard G Posner; William S Hlavacek
Journal:  iScience       Date:  2019-08-28
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  10 in total

1.  Bayesian calibration, process modeling and uncertainty quantification in biotechnology.

Authors:  Laura Marie Helleckes; Michael Osthege; Wolfgang Wiechert; Eric von Lieres; Marco Oldiges
Journal:  PLoS Comput Biol       Date:  2022-03-07       Impact factor: 4.475

2.  A protocol for dynamic model calibration.

Authors:  Alejandro F Villaverde; Dilan Pathirana; Fabian Fröhlich; Jan Hasenauer; Julio R Banga
Journal:  Brief Bioinform       Date:  2022-01-17       Impact factor: 11.622

3.  Combining hypothesis- and data-driven neuroscience modeling in FAIR workflows.

Authors:  Olivia Eriksson; Upinder Singh Bhalla; Kim T Blackwell; Sharon M Crook; Daniel Keller; Andrei Kramer; Marja-Leena Linne; Ausra Saudargienė; Rebecca C Wade; Jeanette Hellgren Kotaleski
Journal:  Elife       Date:  2022-07-06       Impact factor: 8.713

4.  Disentangling ERBB Signaling in Breast Cancer Subtypes-A Model-Based Analysis.

Authors:  Svenja Kemmer; Mireia Berdiel-Acer; Eileen Reinz; Johanna Sonntag; Nooraldeen Tarade; Stephan Bernhardt; Mirjam Fehling-Kaschek; Max Hasmann; Ulrike Korf; Stefan Wiemann; Jens Timmer
Journal:  Cancers (Basel)       Date:  2022-05-12       Impact factor: 6.575

5.  Deciphering signal transduction networks in the liver by mechanistic mathematical modelling.

Authors:  Lorenza A D'Alessandro; Ursula Klingmüller; Marcel Schilling
Journal:  Biochem J       Date:  2022-06-30       Impact factor: 3.766

6.  Dynamic modeling of Nrf2 pathway activation in liver cells after toxicant exposure.

Authors:  Steven Hiemstra; Mirjam Fehling-Kaschek; Isoude A Kuijper; Bob van de Water; Daniel Kaschek; Luc J M Bischoff; Lukas S Wijaya; Marcus Rosenblatt; Jeroen Esselink; Allard van Egmond; Jornt Mos; Joost B Beltman; Jens Timmer
Journal:  Sci Rep       Date:  2022-05-05       Impact factor: 4.996

7.  COVID-19 outbreak in Wuhan demonstrates the limitations of publicly available case numbers for epidemiological modeling.

Authors:  Elba Raimúndez; Erika Dudkin; Jakob Vanhoefer; Emad Alamoudi; Simon Merkt; Lara Fuhrmann; Fan Bai; Jan Hasenauer
Journal:  Epidemics       Date:  2021-01-29       Impact factor: 5.324

8.  Mini-batch optimization enables training of ODE models on large-scale datasets.

Authors:  Paul Stapor; Leonard Schmiester; Christoph Wierling; Simon Merkt; Dilan Pathirana; Bodo M H Lange; Daniel Weindl; Jan Hasenauer
Journal:  Nat Commun       Date:  2022-01-10       Impact factor: 17.694

9.  BlotIt-Optimal alignment of Western blot and qPCR experiments.

Authors:  Svenja Kemmer; Severin Bang; Marcus Rosenblatt; Jens Timmer; Daniel Kaschek
Journal:  PLoS One       Date:  2022-08-10       Impact factor: 3.752

10.  Fides: Reliable trust-region optimization for parameter estimation of ordinary differential equation models.

Authors:  Fabian Fröhlich; Peter K Sorger
Journal:  PLoS Comput Biol       Date:  2022-07-13       Impact factor: 4.779

  10 in total

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