Reduction of the chemical master equation for gene regulatory networks using proper generalized decompositions

被引:21
作者
Ammar, Amine [2 ]
Cueto, Elias [1 ]
Chinesta, Francisco [3 ]
机构
[1] Univ Zaragoza, Aragon Inst Engn Res, E-50018 Zaragoza, Spain
[2] Arts & Metiers Paris Tech, Angers, France
[3] Ecole Cent Nantes, EADS Corp Fdn Int Chair, Nantes, France
关键词
gene regulatory networks; chemical master equation; curse of dimensionality; proper generalized decomposition; STOCHASTIC SIMULATION; SOLVERS; FAMILY;
D O I
10.1002/cnm.2476
中图分类号
R318 [生物医学工程];
学科分类号
0831 ;
摘要
The numerical solution of the chemical master equation (CME) governing gene regulatory networks and cell signaling processes remains a challenging task owing to its complexity, exponentially growing with the number of species involved. Although most of the existing techniques rely on the use of Monte Carlo-like techniques, we present here a new technique based on the approximation of the unknown variable (the probability of having a particular chemical state) in terms of a finite sum of separable functions. In this framework, the complexity of the CME grows only linearly with the number of state space dimensions. This technique generalizes the so-called Hartree approximation, by using terms as needed in the finite sums decomposition for ensuring convergence. But noteworthy, the ease of the approximation allows for an easy treatment of unknown parameters (as?is frequently the case when modeling gene regulatory networks, for instance). These unknown parameters can be considered as new space dimensions. In this way, the proposed method provides solutions for any value of the unknown parameters (within some interval of arbitrary size) in one execution of the program. Copyright (c) 2012 John Wiley & Sons, Ltd.
引用
收藏
页码:960 / 973
页数:14
相关论文
共 19 条
[1]   The nanometric and micrometric scales of the structure and mechanics of materials revisited: An introduction to the challenges of fully deterministic numerical descriptions [J].
Ammar, A. ;
Chinesta, F. ;
Joyot, P. .
INTERNATIONAL JOURNAL FOR MULTISCALE COMPUTATIONAL ENGINEERING, 2008, 6 (03) :191-213
[2]   A new family of solvers for some classes of multidimensional partial differential equations encountered in kinetic theory modelling of complex fluids - Part II: Transient simulation using space-time separated representations [J].
Ammar, A. ;
Mokdad, B. ;
Chinesta, F. ;
Keunings, R. .
JOURNAL OF NON-NEWTONIAN FLUID MECHANICS, 2007, 144 (2-3) :98-121
[3]   A new family of solvers for some, classes of multidimensional partial differential equations encountered in kinetic theory modeling of complex fluids [J].
Ammar, A. ;
Mokdad, B. ;
Chinesta, F. ;
Keunings, R. .
JOURNAL OF NON-NEWTONIAN FLUID MECHANICS, 2006, 139 (03) :153-176
[4]  
Bungartz HJ, 2004, ACT NUMERIC, V13, P147, DOI 10.1017/S0962492904000182
[5]  
CANCES E., 2003, HDB NUMERICAL ANAL, P3, DOI 10.1016/S1570-8659(03)10003-8
[6]   On the reduction of stochastic kinetic theory models of complex fluids [J].
Chinesta, F. ;
Ammar, A. ;
Falco, A. ;
Laso, M. .
MODELLING AND SIMULATION IN MATERIALS SCIENCE AND ENGINEERING, 2007, 15 (06) :639-652
[7]   A Short Review on Model Order Reduction Based on Proper Generalized Decomposition [J].
Chinesta, Francisco ;
Ladeveze, Pierre ;
Cueto, Elias .
ARCHIVES OF COMPUTATIONAL METHODS IN ENGINEERING, 2011, 18 (04) :395-404
[8]   Recent Advances and New Challenges in the Use of the Proper Generalized Decomposition for Solving Multidimensional Models [J].
Chinesta, Francisco ;
Ammar, Amine ;
Cueto, Elias .
ARCHIVES OF COMPUTATIONAL METHODS IN ENGINEERING, 2010, 17 (04) :327-350
[9]   Approximate accelerated stochastic simulation of chemically reacting systems [J].
Gillespie, DT .
JOURNAL OF CHEMICAL PHYSICS, 2001, 115 (04) :1716-1733
[10]   EXACT STOCHASTIC SIMULATION OF COUPLED CHEMICAL-REACTIONS [J].
GILLESPIE, DT .
JOURNAL OF PHYSICAL CHEMISTRY, 1977, 81 (25) :2340-2361