Global parameter estimation for a eukaryotic cell cycle model in systems biology

The complicated process by which a yeast cell divides, known as the cell cycle, has been modeled by a system of 26 nonlinear ordinary differential equations (ODEs) with 149 parameters. This model captures the chemical kinetics of the regulatory networks controlling the cell division process in budding yeast cells. Empirical data is discrete and matched against discrete inferences (e.g., whether a particular mutant cell lives or dies) computed from the ODE solution trajectories. The problem of estimating the ODE parameters to best fit the model to the data is a 149-dimensional global optimization problem attacked by the deterministic algorithm VTDIRECT95 and by the nondeterministic algorithms differential evolution, QNSTOP, and simulated annealing, whose performances are compared.

[1]  John J. Tyson,et al.  Optimization and model reduction in the high dimensional parameter space of a budding yeast cell cycle model , 2013, BMC Systems Biology.

[2]  J. Mitchison,et al.  The biology of the cell cycle , 1971 .

[3]  Andrew W. Murray,et al.  The Cell Cycle , 1989 .

[4]  David O. Morgan,et al.  The Cell Cycle: Principles of Control , 2014 .

[5]  R R Neptune,et al.  Simulated parallel annealing within a neighborhood for optimization of biomechanical systems. , 2005, Journal of biomechanics.

[6]  Bertil Gustafsson,et al.  Numerical Methods for Differential Equations , 2011 .

[7]  Layne T. Watson,et al.  A Fully Distribute Parallel Global Search Algorithm , 2001, PPSC.

[8]  Masha Sosonkina,et al.  Remark on Algorithm 897 , 2015 .

[9]  Frederick R. Cross,et al.  Multiple levels of cyclin specificity in cell-cycle control , 2007, Nature Reviews Molecular Cell Biology.

[10]  William L. Goffe,et al.  SIMANN: FORTRAN module to perform Global Optimization of Statistical Functions with Simulated Annealing , 1992 .

[11]  Michael W. Trosset,et al.  Quasi-newton methods for stochastic optimization and proximity-based methods for disparate information fusion , 2012 .

[12]  Nicholas I. M. Gould,et al.  Trust Region Methods , 2000, MOS-SIAM Series on Optimization.

[13]  Teeraphan Laomettachit,et al.  Mathematical modeling approaches for dynamical analysis of protein regulatory networks with applications to the budding yeast cell cycle and the circadian rhythm in cyanobacteria , 2011 .

[14]  W. H. Carter,et al.  Confidence regions for constrained optima in response-surface experiments. , 1983, Biometrics.

[15]  Jerzy S. Respondek Recursive numerical recipes for the high efficient inversion of the confluent Vandermonde matrices , 2013, Appl. Math. Comput..

[16]  John J. Tyson,et al.  A Stochastic Model Correctly Predicts Changes in Budding Yeast Cell Cycle Dynamics upon Periodic Expression of CLN2 , 2014, PloS one.

[17]  John E. Dennis,et al.  Numerical methods for unconstrained optimization and nonlinear equations , 1983, Prentice Hall series in computational mathematics.

[18]  C. D. Perttunen,et al.  Lipschitzian optimization without the Lipschitz constant , 1993 .