# Size of variable arrays: sizeAlgebraic = 2 sizeStates = 13 sizeConstants = 30 from math import * from numpy import * def createLegends(): legend_states = [""] * sizeStates legend_rates = [""] * sizeStates legend_algebraic = [""] * sizeAlgebraic legend_voi = "" legend_constants = [""] * sizeConstants legend_voi = "time in component environment (minute)" legend_states[0] = "cAMP in component cAMP (micromolar)" legend_constants[0] = "Ko in component cAMP (dimensionless)" legend_constants[1] = "Ka in component cAMP (per_micromolar)" legend_constants[2] = "Kb in component cAMP (per_micromolar)" legend_constants[3] = "Kdsm in component cAMP (micromolar)" legend_constants[4] = "Vmsm in component cAMP (flux)" legend_constants[5] = "Vdsm in component cAMP (flux)" legend_algebraic[0] = "ACTH in component cAMP (micromolar)" legend_algebraic[1] = "IS in component IS (dimensionless)" legend_constants[6] = "Crpt in component IS (dimensionless)" legend_constants[7] = "K in component IS (dimensionless)" legend_constants[8] = "Kd in component IS (micromolar)" legend_constants[9] = "n in component IS (dimensionless)" legend_states[1] = "V in component V (flux)" legend_constants[10] = "P in component V (micromolar_per_minute2)" legend_constants[11] = "Q in component V (first_order_rate_constant)" legend_states[2] = "W in component W (flux)" legend_constants[12] = "T in component W (micromolar2_per_minute2)" legend_constants[13] = "U in component W (first_order_rate_constant)" legend_states[3] = "CHOC in component CHOC (micromolar)" legend_constants[14] = "Lmtr in component model_parameters (first_order_rate_constant)" legend_states[4] = "Kmtr in component Kmtr (first_order_rate_constant)" legend_states[5] = "CHOM in component CHOM (micromolar)" legend_constants[15] = "Kbac in component model_parameters (first_order_rate_constant)" legend_states[6] = "Kfor in component Kfor (first_order_rate_constant)" legend_constants[16] = "Kcb in component model_parameters (first_order_rate_constant)" legend_constants[17] = "Kcf in component model_parameters (first_order_rate_constant)" legend_states[7] = "CHON in component CHON (micromolar)" legend_states[8] = "CHOL in component CHOL (micromolar)" legend_constants[18] = "C in component Kmtr (per_minute2)" legend_constants[19] = "D in component Kmtr (first_order_rate_constant)" legend_constants[20] = "R in component Kfor (per_minute2)" legend_constants[21] = "S in component Kfor (first_order_rate_constant)" legend_constants[22] = "Vm in component model_parameters (flux)" legend_constants[23] = "Km in component model_parameters (micromolar)" legend_states[9] = "PREG in component PREG (micromolar)" legend_constants[24] = "Vmptr in component model_parameters (flux)" legend_constants[25] = "Kmptr in component model_parameters (micromolar)" legend_states[10] = "PRO in component PRO (micromolar)" legend_constants[26] = "HA in component PRO (dimensionless)" legend_constants[27] = "AH in component model_parameters (first_order_rate_constant)" legend_states[11] = "HYPR in component HYPR (micromolar)" legend_constants[28] = "HY in component model_parameters (first_order_rate_constant)" legend_states[12] = "CORT in component CORT (micromolar)" legend_constants[29] = "LH in component CORT (first_order_rate_constant)" legend_rates[0] = "d/dt cAMP in component cAMP (micromolar)" legend_rates[1] = "d/dt V in component V (flux)" legend_rates[2] = "d/dt W in component W (flux)" legend_rates[3] = "d/dt CHOC in component CHOC (micromolar)" legend_rates[5] = "d/dt CHOM in component CHOM (micromolar)" legend_rates[8] = "d/dt CHOL in component CHOL (micromolar)" legend_rates[4] = "d/dt Kmtr in component Kmtr (first_order_rate_constant)" legend_rates[6] = "d/dt Kfor in component Kfor (first_order_rate_constant)" legend_rates[7] = "d/dt CHON in component CHON (micromolar)" legend_rates[9] = "d/dt PREG in component PREG (micromolar)" legend_rates[10] = "d/dt PRO in component PRO (micromolar)" legend_rates[11] = "d/dt HYPR in component HYPR (micromolar)" legend_rates[12] = "d/dt CORT in component CORT (micromolar)" return (legend_states, legend_algebraic, legend_voi, legend_constants) def initConsts(): constants = [0.0] * sizeConstants; states = [0.0] * sizeStates; states[0] = 0.95 constants[0] = 0.013 constants[1] = 10 constants[2] = 1000000.0 constants[3] = 10.0 constants[4] = 6.0 constants[5] = 10.0 constants[6] = 3.0 constants[7] = 80.0 constants[8] = 2.11 constants[9] = 4.0 states[1] = 11.3 constants[10] = 0.052 constants[11] = 0.042 states[2] = 10.0 constants[12] = 8.0 constants[13] = 0.0015 states[3] = 532.0 constants[14] = 1.65 states[4] = 0.446 states[5] = 139.0 constants[15] = 10.0 states[6] = 0.370 constants[16] = 0.01 constants[17] = 0.00033 states[7] = 3.03 states[8] = 3000.0 constants[18] = 6.25 constants[19] = 125.0 constants[20] = 3.0 constants[21] = 76.0 constants[22] = 1890.0 constants[23] = 270.0 states[9] = 6.56 constants[24] = 500.0 constants[25] = 150.0 states[10] = 0.64 constants[26] = 0.5 constants[27] = 16.4 states[11] = 0.64 constants[28] = 16.4 states[12] = 5.2 constants[29] = 0.724 return (states, constants) def computeRates(voi, states, constants): rates = [0.0] * sizeStates; algebraic = [0.0] * sizeAlgebraic rates[2] = constants[12]*(power(states[3], -1.00000))-constants[13]*states[2] rates[3] = (states[1]+states[2]+constants[14]*states[5])-states[4]*states[3] rates[5] = (states[4]*states[3]+constants[15]*states[7]+constants[17]*states[8])-(constants[14]*states[5]+constants[16]*states[5]+states[6]*states[5]) rates[8] = constants[16]*states[5]-constants[17]*states[8] rates[7] = states[6]*states[5]-(constants[15]*states[7]+(constants[22]*states[7])/(constants[23]+states[7])) rates[9] = (constants[22]*states[7])/(constants[23]+states[7])-(constants[24]*states[9])/(constants[25]+states[9]) rates[10] = constants[26]*((constants[24]*states[9])/(constants[25]+states[9]))-constants[27]*states[10] rates[11] = constants[27]*states[10]-constants[28]*states[11] rates[12] = constants[28]*states[11]-constants[29]*states[12] algebraic[0] = custom_piecewise([greater_equal(voi , 0.00000) & less(voi , 10.0000), 1.20000e-05 , greater_equal(voi , 10.0000) & less(voi , 20.0000), 1.60000e-05 , greater_equal(voi , 20.0000) & less(voi , 35.0000), 1.20000e-05 , greater_equal(voi , 35.0000) & less(voi , 45.0000), 1.60000e-05 , True, 1.20000e-05]) rates[0] = (constants[4]*constants[0]*(1.00000+constants[2]*algebraic[0]))/((1.00000+constants[1]*algebraic[0])+constants[0]*(1.00000+constants[2]*algebraic[0]))-(constants[5]*states[0])/(constants[3]+states[0]) algebraic[1] = (constants[7]*constants[6]*(power(states[0], constants[9])))/(power(constants[8], constants[9])+power(states[0], constants[9])) rates[1] = constants[10]*algebraic[1]-constants[11]*states[1] rates[4] = constants[18]*algebraic[1]-constants[19]*states[4] rates[6] = constants[20]*algebraic[1]-constants[21]*states[6] return(rates) def computeAlgebraic(constants, states, voi): algebraic = array([[0.0] * len(voi)] * sizeAlgebraic) states = array(states) voi = array(voi) algebraic[0] = custom_piecewise([greater_equal(voi , 0.00000) & less(voi , 10.0000), 1.20000e-05 , greater_equal(voi , 10.0000) & less(voi , 20.0000), 1.60000e-05 , greater_equal(voi , 20.0000) & less(voi , 35.0000), 1.20000e-05 , greater_equal(voi , 35.0000) & less(voi , 45.0000), 1.60000e-05 , True, 1.20000e-05]) algebraic[1] = (constants[7]*constants[6]*(power(states[0], constants[9])))/(power(constants[8], constants[9])+power(states[0], constants[9])) return algebraic def custom_piecewise(cases): """Compute result of a piecewise function""" return select(cases[0::2],cases[1::2]) def solve_model(): """Solve model with ODE solver""" from scipy.integrate import ode # Initialise constants and state variables (init_states, constants) = initConsts() # Set timespan to solve over voi = linspace(0, 10, 500) # Construct ODE object to solve r = ode(computeRates) r.set_integrator('vode', method='bdf', atol=1e-06, rtol=1e-06, max_step=1) r.set_initial_value(init_states, voi[0]) r.set_f_params(constants) # Solve model states = array([[0.0] * len(voi)] * sizeStates) states[:,0] = init_states for (i,t) in enumerate(voi[1:]): if r.successful(): r.integrate(t) states[:,i+1] = r.y else: break # Compute algebraic variables algebraic = computeAlgebraic(constants, states, voi) return (voi, states, algebraic) def plot_model(voi, states, algebraic): """Plot variables against variable of integration""" import pylab (legend_states, legend_algebraic, legend_voi, legend_constants) = createLegends() pylab.figure(1) pylab.plot(voi,vstack((states,algebraic)).T) pylab.xlabel(legend_voi) pylab.legend(legend_states + legend_algebraic, loc='best') pylab.show() if __name__ == "__main__": (voi, states, algebraic) = solve_model() plot_model(voi, states, algebraic)