Description Usage Arguments Details Value Author(s) See Also Examples
This function configures returns the objective function that can be used to evaluate the fitness of a logic based ODE model using a particular set of parameters. This function can be particularly useful if you are planing to couple a nonlinear optimization solver. The returned value of the objective function corresponds to the mean squared value normalized by the number of data points.
1 2 3 4 | getLBodeContObjFunction(cnolist, model, ode_parameters, indices=NULL, time = 1,
verbose = 0, transfer_function = 3, reltol = 1e-04, atol = 0.001, maxStepSize = Inf,
maxNumSteps = 1e+05, maxErrTestsFails = 50, nan_fac = 1, lambda_tau=0, lambda_k=0,
bootstrap=F, SSpenalty_fac=0, SScontrolPenalty_fac=0, boot_seed=sample(1:10000,1))
|
cnolist |
A list containing the experimental design and data. |
model |
The logic model to be simulated. |
ode_parameters |
A list with the ODEs parameter information. Obtained with |
indices |
Indices to map data in the model. Obtained with indexFinder function from CellNOptR. |
time |
An integer with the index of the time point to start the simulation. Default is 1. |
verbose |
A logical value that triggers a set of comments. |
transfer_function |
The type of used transfer. Use 1 for no transfer function, 2 for Hill function and 3 for normalized Hill function. |
reltol |
Relative Tolerance for numerical integration. |
atol |
Absolute tolerance for numerical integration. |
maxStepSize |
The maximum step size allowed to ODE solver. |
maxNumSteps |
The maximum number of internal steps between two points being sampled before the solver fails. |
maxErrTestsFails |
Specifies the maximum number of error test failures permitted in attempting one step. |
nan_fac |
A penalty for each data point the model is not able to simulate. We recommend higher than 0 and smaller that 1. |
lambda_tau |
Tunable regularisation parameters to penalise L1-norm of parameters tau and induce sparsity. We recommend testing values between 0 and 100 (in log scale) to find best compromise between good fit and sparse model. Default =0, corresponding to no regularisation. |
lambda_k |
Tunable regularisation parameters to penalise L1-norm of parameters k and induce sparsity. We recommend testing values between 0 and 100 (in log scale) to find best compromise between good fit and sparse model. Default =0, corresponding to no regularisation. |
bootstrap |
If set to TRUE performs random sampling with replacement of the measurements used in the optimisation (to be run multiple times to get bootstrapped distribution of parameters). Default =FALSE, no bootstrapping. |
SSpenalty_fac |
Penalty factor for penalising solutions which do not reach steady state. Default =0. |
SScontrolPenalty_fac |
Penalty factor for penalising solutions for which the control (unperturbed) condition (assumed to be first row) does not reach steady state. Default =0. |
boot_seed |
Seed used for random sampling if bootstrap=TRUE. Default chose random seed between 0 and 10000 |
Check CellNOptR
for details about the cnolist and the model format.
For more details in the configuration of the ODE solver check the CVODES manual.
Returns a function to evaluate the model fitness. This function receives a vector containing both continuous parameters and integer values representing which reactions should be kept in the model.
David Henriques, Thomas Cokelaer, Federica Eduati
1 2 3 4 5 6 7 8 9 10 11 | library(CNORode)
data("ToyCNOlist",package="CNORode");
data("ToyModel",package="CNORode");
data("ToyIndices",package="CNORode");
ode_parameters=createLBodeContPars(model,random=TRUE);
minlp_obj_function=getLBodeContObjFunction(cnolistCNORodeExample, model,ode_parameters,indices);
x=ode_parameters$parValues;
f=minlp_obj_function(x);
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