/* * This code is generated by BioUML FrameWork * for BIOMD0000000064.xml diagram at 2008.03.20 15:04:49 */ import biouml.plugins.simulation.ae.NewtonSolver; import biouml.plugins.simulation.java.JavaBaseModel; import ru.biosoft.math.MathRoutines; public class BIOMD0000000064 extends JavaBaseModel { /* * Write rules to calculate equation parameters */ private void __internalVarInitFunc_0(double time, double[] x) { L_PFK = Lzero_5*Math.pow(((1 + CiPFKATP_5*((x[8] - 4*KeqAK_5*x[8] - SUMAXP_5 + Math.pow((Math.pow(x[8], 2) - 4*KeqAK_5*Math.pow(x[8], 2) - 2*x[8]*SUMAXP_5 + 8*KeqAK_5*x[8]*SUMAXP_5 + Math.pow(SUMAXP_5, 2)), 0.5))/(2 - 8*KeqAK_5)/KiPFKATP_5))/(1 + (x[8] - 4*KeqAK_5*x[8] - SUMAXP_5 + Math.pow((Math.pow(x[8], 2) - 4*KeqAK_5*Math.pow(x[8], 2) - 2*x[8]*SUMAXP_5 + 8*KeqAK_5*x[8]*SUMAXP_5 + Math.pow(SUMAXP_5, 2)), 0.5))/(2 - 8*KeqAK_5)/KiPFKATP_5)), 2)*Math.pow(((1 + CPFKAMP_5*(2*KeqAK_5*Math.pow((SUMAXP_5 - Math.pow((Math.pow(x[8], 2) - 4*KeqAK_5*Math.pow(x[8], 2) - 2*x[8]*SUMAXP_5 + 8*KeqAK_5*x[8]*SUMAXP_5 + Math.pow(SUMAXP_5, 2)), 0.5)), 2)/((-1.0 + 4*KeqAK_5)*(-x[8] + 4*KeqAK_5*x[8] + SUMAXP_5 - Math.pow((Math.pow(x[8], 2) - 4*KeqAK_5*Math.pow(x[8], 2) - 2*x[8]*SUMAXP_5 + 8*KeqAK_5*x[8]*SUMAXP_5 + Math.pow(SUMAXP_5, 2)), 0.5))))/KPFKAMP_5)/(1 + 2*KeqAK_5*Math.pow((SUMAXP_5 - Math.pow((Math.pow(x[8], 2) - 4*KeqAK_5*Math.pow(x[8], 2) - 2*x[8]*SUMAXP_5 + 8*KeqAK_5*x[8]*SUMAXP_5 + Math.pow(SUMAXP_5, 2)), 0.5)), 2)/((-1.0 + 4*KeqAK_5)*(-x[8] + 4*KeqAK_5*x[8] + SUMAXP_5 - Math.pow((Math.pow(x[8], 2) - 4*KeqAK_5*Math.pow(x[8], 2) - 2*x[8]*SUMAXP_5 + 8*KeqAK_5*x[8]*SUMAXP_5 + Math.pow(SUMAXP_5, 2)), 0.5)))/KPFKAMP_5)), 2)*Math.pow(((1 + CPFKF26BP_5*F26BP_5/KPFKF26BP_5 + CPFKF16BP_5*x[2]/KPFKF16BP_5)/(1 + F26BP_5/KPFKF26BP_5 + x[2]/KPFKF16BP_5)), 2); Lambda1 = x[3]/KmPFKF6P_5; Lambda2 = (x[8] - 4*KeqAK_5*x[8] - SUMAXP_5 + Math.pow((Math.pow(x[8], 2) - 4*KeqAK_5*Math.pow(x[8], 2) - 2*x[8]*SUMAXP_5 + 8*KeqAK_5*x[8]*SUMAXP_5 + Math.pow(SUMAXP_5, 2)), 0.5))/(2 - 8*KeqAK_5)/KmPFKATP_5; R_PFK = 1 + x[3]/KmPFKF6P_5 + (x[8] - 4*KeqAK_5*x[8] - SUMAXP_5 + Math.pow((Math.pow(x[8], 2) - 4*KeqAK_5*Math.pow(x[8], 2) - 2*x[8]*SUMAXP_5 + 8*KeqAK_5*x[8]*SUMAXP_5 + Math.pow(SUMAXP_5, 2)), 0.5))/(2 - 8*KeqAK_5)/KmPFKATP_5 + gR_5*x[3]/KmPFKF6P_5*((x[8] - 4*KeqAK_5*x[8] - SUMAXP_5 + Math.pow((Math.pow(x[8], 2) - 4*KeqAK_5*Math.pow(x[8], 2) - 2*x[8]*SUMAXP_5 + 8*KeqAK_5*x[8]*SUMAXP_5 + Math.pow(SUMAXP_5, 2)), 0.5))/(2 - 8*KeqAK_5)/KmPFKATP_5); T_PFK = 1 + CPFKATP_5*((x[8] - 4*KeqAK_5*x[8] - SUMAXP_5 + Math.pow((Math.pow(x[8], 2) - 4*KeqAK_5*Math.pow(x[8], 2) - 2*x[8]*SUMAXP_5 + 8*KeqAK_5*x[8]*SUMAXP_5 + Math.pow(SUMAXP_5, 2)), 0.5))/(2 - 8*KeqAK_5))/KmPFKATP_5; } /* * Write rules to calculate equation parameters excluding internal variables. */ public void __internalRateVarInitFunc_0(double time, double[] x) { rate_vADH = -_extracellular_cytosol_*(vADH_VmADH_15/(vADH_KiADHNAD_15*vADH_KmADHETOH_15)*(x[6]*_extracellular_cytosol_ETOH_ - x[7]*x[0]/vADH_KeqADH_15)/(1 + x[6]/vADH_KiADHNAD_15 + vADH_KmADHNAD_15*_extracellular_cytosol_ETOH_/(vADH_KiADHNAD_15*vADH_KmADHETOH_15) + vADH_KmADHNADH_15*x[0]/(vADH_KiADHNADH_15*vADH_KmADHACE_15) + x[7]/vADH_KiADHNADH_15 + x[6]*_extracellular_cytosol_ETOH_/(vADH_KiADHNAD_15*vADH_KmADHETOH_15) + vADH_KmADHNADH_15*x[6]*x[0]/(vADH_KiADHNAD_15*vADH_KiADHNADH_15*vADH_KmADHACE_15) + vADH_KmADHNAD_15*_extracellular_cytosol_ETOH_*x[7]/(vADH_KiADHNAD_15*vADH_KmADHETOH_15*vADH_KiADHNADH_15) + x[7]*x[0]/(vADH_KiADHNADH_15*vADH_KmADHACE_15) + x[6]*_extracellular_cytosol_ETOH_*x[0]/(vADH_KiADHNAD_15*vADH_KmADHETOH_15*vADH_KiADHACE_15) + _extracellular_cytosol_ETOH_*x[7]*x[0]/(vADH_KiADHETOH_15*vADH_KiADHNADH_15*vADH_KmADHACE_15))); rate_vALD = _extracellular_cytosol_*vALD_VmALD_6/vALD_KmALDF16P_6*(x[2] - vALD_KeqTPI_6/(1 + vALD_KeqTPI_6)*x[13]*(1/(1 + vALD_KeqTPI_6))*x[13]/vALD_KeqALD_6)/(1 + x[2]/vALD_KmALDF16P_6 + vALD_KeqTPI_6/(1 + vALD_KeqTPI_6)*x[13]/vALD_KmALDGAP_6 + 1/(1 + vALD_KeqTPI_6)*x[13]/vALD_KmALDDHAP_6 + vALD_KeqTPI_6/(1 + vALD_KeqTPI_6)*x[13]*(1/(1 + vALD_KeqTPI_6))*x[13]/(vALD_KmALDGAP_6*vALD_KmALDDHAP_6) + x[2]*(vALD_KeqTPI_6/(1 + vALD_KeqTPI_6))*x[13]/(vALD_KmALDGAPi_6*vALD_KmALDF16P_6)); rate_vATP = _extracellular_cytosol_*vATP_KATPASE_17*((x[8] - 4*vATP_KeqAK_17*x[8] - vATP_SUMAXP_17 + Math.pow((Math.pow(x[8], 2) - 4*vATP_KeqAK_17*Math.pow(x[8], 2) - 2*x[8]*vATP_SUMAXP_17 + 8*vATP_KeqAK_17*x[8]*vATP_SUMAXP_17 + Math.pow(vATP_SUMAXP_17, 2)), 0.5))/(2 - 8*vATP_KeqAK_17)); rate_vENO = _extracellular_cytosol_*vENO_VmENO_10/vENO_KmENOP2G_10*(x[9] - x[11]/vENO_KeqENO_10)/(1 + x[9]/vENO_KmENOP2G_10 + x[11]/vENO_KmENOPEP_10); rate_vG3PDH = _extracellular_cytosol_*vG3PDH_VmG3PDH_16/(vG3PDH_KmG3PDHDHAP_16*vG3PDH_KmG3PDHNADH_16)*(1/(1 + vG3PDH_KeqTPI_16)*x[13]*x[7] - _extracellular_cytosol_GLY_*x[6]/vG3PDH_KeqG3PDH_16)/((1 + 1/(1 + vG3PDH_KeqTPI_16)*x[13]/vG3PDH_KmG3PDHDHAP_16 + _extracellular_cytosol_GLY_/vG3PDH_KmG3PDHGLY_16)*(1 + x[7]/vG3PDH_KmG3PDHNADH_16 + x[6]/vG3PDH_KmG3PDHNAD_16)); rate_vGAPDH = _extracellular_cytosol_*(vGAPDH_VmGAPDHf_7*(vGAPDH_KeqTPI_7/(1 + vGAPDH_KeqTPI_7))*x[13]*x[6]/(vGAPDH_KmGAPDHGAP_7*vGAPDH_KmGAPDHNAD_7) - vGAPDH_VmGAPDHr_7*x[1]*x[7]/(vGAPDH_KmGAPDHBPG_7*vGAPDH_KmGAPDHNADH_7))/((1 + vGAPDH_KeqTPI_7/(1 + vGAPDH_KeqTPI_7)*x[13]/vGAPDH_KmGAPDHGAP_7 + x[1]/vGAPDH_KmGAPDHBPG_7)*(1 + x[6]/vGAPDH_KmGAPDHNAD_7 + x[7]/vGAPDH_KmGAPDHNADH_7)); rate_vGLK = _extracellular_cytosol_*vGLK_VmGLK_1/(vGLK_KmGLKGLCi_1*vGLK_KmGLKATP_1)*(x[5]*((x[8] - 4*vGLK_KeqAK_1*x[8] - vGLK_SUMAXP_1 + Math.pow((Math.pow(x[8], 2) - 4*vGLK_KeqAK_1*Math.pow(x[8], 2) - 2*x[8]*vGLK_SUMAXP_1 + 8*vGLK_KeqAK_1*x[8]*vGLK_SUMAXP_1 + Math.pow(vGLK_SUMAXP_1, 2)), 0.5))/(2 - 8*vGLK_KeqAK_1)) - x[4]*(vGLK_SUMAXP_1 - Math.pow((Math.pow(x[8], 2) - 4*vGLK_KeqAK_1*Math.pow(x[8], 2) - 2*x[8]*vGLK_SUMAXP_1 + 8*vGLK_KeqAK_1*x[8]*vGLK_SUMAXP_1 + Math.pow(vGLK_SUMAXP_1, 2)), 0.5))/(1 - 4*vGLK_KeqAK_1)/vGLK_KeqGLK_1)/((1 + x[5]/vGLK_KmGLKGLCi_1 + x[4]/vGLK_KmGLKG6P_1)*(1 + (x[8] - 4*vGLK_KeqAK_1*x[8] - vGLK_SUMAXP_1 + Math.pow((Math.pow(x[8], 2) - 4*vGLK_KeqAK_1*Math.pow(x[8], 2) - 2*x[8]*vGLK_SUMAXP_1 + 8*vGLK_KeqAK_1*x[8]*vGLK_SUMAXP_1 + Math.pow(vGLK_SUMAXP_1, 2)), 0.5))/(2 - 8*vGLK_KeqAK_1)/vGLK_KmGLKATP_1 + (vGLK_SUMAXP_1 - Math.pow((Math.pow(x[8], 2) - 4*vGLK_KeqAK_1*Math.pow(x[8], 2) - 2*x[8]*vGLK_SUMAXP_1 + 8*vGLK_KeqAK_1*x[8]*vGLK_SUMAXP_1 + Math.pow(vGLK_SUMAXP_1, 2)), 0.5))/(1 - 4*vGLK_KeqAK_1)/vGLK_KmGLKADP_1)); rate_vGLT = vGLT_VmGLT_14/vGLT_KmGLTGLCo_14*(extracellular*_extracellular_GLCo_ - _extracellular_cytosol_*x[5]/vGLT_KeqGLT_14)/(1 + _extracellular_GLCo_/vGLT_KmGLTGLCo_14 + x[5]/vGLT_KmGLTGLCi_14 + 0.91*_extracellular_GLCo_*x[5]/(vGLT_KmGLTGLCo_14*vGLT_KmGLTGLCi_14)); rate_vGLYCO = _extracellular_cytosol_*vGLYCO_KGLYCOGEN_3; rate_vPDC = _extracellular_cytosol_*vPDC_VmPDC_12*(Math.pow(x[12], vPDC_nPDC_12)/Math.pow(vPDC_KmPDCPYR_12, vPDC_nPDC_12))/(1 + Math.pow(x[12], vPDC_nPDC_12)/Math.pow(vPDC_KmPDCPYR_12, vPDC_nPDC_12)); rate_vPFK = _extracellular_cytosol_*vPFK_VmPFK_5*gR_5*Lambda1*Lambda2*R_PFK/(Math.pow(R_PFK, 2) + L_PFK*Math.pow(T_PFK, 2)); rate_vPGI = _extracellular_cytosol_*vPGI_VmPGI_2/vPGI_KmPGIG6P_2*(x[4] - x[3]/vPGI_KeqPGI_2)/(1 + x[4]/vPGI_KmPGIG6P_2 + x[3]/vPGI_KmPGIF6P_2); rate_vPGK = _extracellular_cytosol_*vPGK_VmPGK_8/(vPGK_KmPGKP3G_8*vPGK_KmPGKATP_8)*(vPGK_KeqPGK_8*x[1]*(vPGK_SUMAXP_8 - Math.pow((Math.pow(x[8], 2) - 4*vPGK_KeqAK_8*Math.pow(x[8], 2) - 2*x[8]*vPGK_SUMAXP_8 + 8*vPGK_KeqAK_8*x[8]*vPGK_SUMAXP_8 + Math.pow(vPGK_SUMAXP_8, 2)), 0.5))/(1 - 4*vPGK_KeqAK_8) - x[10]*((x[8] - 4*vPGK_KeqAK_8*x[8] - vPGK_SUMAXP_8 + Math.pow((Math.pow(x[8], 2) - 4*vPGK_KeqAK_8*Math.pow(x[8], 2) - 2*x[8]*vPGK_SUMAXP_8 + 8*vPGK_KeqAK_8*x[8]*vPGK_SUMAXP_8 + Math.pow(vPGK_SUMAXP_8, 2)), 0.5))/(2 - 8*vPGK_KeqAK_8)))/((1 + x[1]/vPGK_KmPGKBPG_8 + x[10]/vPGK_KmPGKP3G_8)*(1 + (x[8] - 4*vPGK_KeqAK_8*x[8] - vPGK_SUMAXP_8 + Math.pow((Math.pow(x[8], 2) - 4*vPGK_KeqAK_8*Math.pow(x[8], 2) - 2*x[8]*vPGK_SUMAXP_8 + 8*vPGK_KeqAK_8*x[8]*vPGK_SUMAXP_8 + Math.pow(vPGK_SUMAXP_8, 2)), 0.5))/(2 - 8*vPGK_KeqAK_8)/vPGK_KmPGKATP_8 + (vPGK_SUMAXP_8 - Math.pow((Math.pow(x[8], 2) - 4*vPGK_KeqAK_8*Math.pow(x[8], 2) - 2*x[8]*vPGK_SUMAXP_8 + 8*vPGK_KeqAK_8*x[8]*vPGK_SUMAXP_8 + Math.pow(vPGK_SUMAXP_8, 2)), 0.5))/(1 - 4*vPGK_KeqAK_8)/vPGK_KmPGKADP_8)); rate_vPGM = _extracellular_cytosol_*vPGM_VmPGM_9/vPGM_KmPGMP3G_9*(x[10] - x[9]/vPGM_KeqPGM_9)/(1 + x[10]/vPGM_KmPGMP3G_9 + x[9]/vPGM_KmPGMP2G_9); rate_vPYK = _extracellular_cytosol_*vPYK_VmPYK_11/(vPYK_KmPYKPEP_11*vPYK_KmPYKADP_11)*(x[11]*(vPYK_SUMAXP_11 - Math.pow((Math.pow(x[8], 2) - 4*vPYK_KeqAK_11*Math.pow(x[8], 2) - 2*x[8]*vPYK_SUMAXP_11 + 8*vPYK_KeqAK_11*x[8]*vPYK_SUMAXP_11 + Math.pow(vPYK_SUMAXP_11, 2)), 0.5))/(1 - 4*vPYK_KeqAK_11) - x[12]*((x[8] - 4*vPYK_KeqAK_11*x[8] - vPYK_SUMAXP_11 + Math.pow((Math.pow(x[8], 2) - 4*vPYK_KeqAK_11*Math.pow(x[8], 2) - 2*x[8]*vPYK_SUMAXP_11 + 8*vPYK_KeqAK_11*x[8]*vPYK_SUMAXP_11 + Math.pow(vPYK_SUMAXP_11, 2)), 0.5))/(2 - 8*vPYK_KeqAK_11))/vPYK_KeqPYK_11)/((1 + x[11]/vPYK_KmPYKPEP_11 + x[12]/vPYK_KmPYKPYR_11)*(1 + (x[8] - 4*vPYK_KeqAK_11*x[8] - vPYK_SUMAXP_11 + Math.pow((Math.pow(x[8], 2) - 4*vPYK_KeqAK_11*Math.pow(x[8], 2) - 2*x[8]*vPYK_SUMAXP_11 + 8*vPYK_KeqAK_11*x[8]*vPYK_SUMAXP_11 + Math.pow(vPYK_SUMAXP_11, 2)), 0.5))/(2 - 8*vPYK_KeqAK_11)/vPYK_KmPYKATP_11 + (vPYK_SUMAXP_11 - Math.pow((Math.pow(x[8], 2) - 4*vPYK_KeqAK_11*Math.pow(x[8], 2) - 2*x[8]*vPYK_SUMAXP_11 + 8*vPYK_KeqAK_11*x[8]*vPYK_SUMAXP_11 + Math.pow(vPYK_SUMAXP_11, 2)), 0.5))/(1 - 4*vPYK_KeqAK_11)/vPYK_KmPYKADP_11)); rate_vSUC = _extracellular_cytosol_*vSUC_KSUCC_13*x[0]; rate_vTreha = _extracellular_cytosol_*vTreha_KTREHALOSE_4; } public void Init() { initialValues = getInitialValues(); /* * Initialize variables */ _extracellular_GLCo_ = 50.0; // initial value of $"extracellular.GLCo" _extracellular_cytosol_ = 1.0; // initial value of $"extracellular.cytosol" _extracellular_cytosol_CO2_ = 1.0; // initial value of $"extracellular.cytosol.CO2" _extracellular_cytosol_ETOH_ = 50.0; // initial value of $"extracellular.cytosol.ETOH" _extracellular_cytosol_GLY_ = 0.15; // initial value of $"extracellular.cytosol.GLY" extracellular = 1.0; // initial value of $extracellular CPFKAMP_5 = 0.0845; // initial value of CPFKAMP_5 CPFKATP_5 = 3.0; // initial value of CPFKATP_5 CPFKF16BP_5 = 0.397; // initial value of CPFKF16BP_5 CPFKF26BP_5 = 0.0174; // initial value of CPFKF26BP_5 CiPFKATP_5 = 100.0; // initial value of CiPFKATP_5 F26BP_5 = 0.02; // initial value of F26BP_5 KPFKAMP_5 = 0.0995; // initial value of KPFKAMP_5 KPFKF16BP_5 = 0.111; // initial value of KPFKF16BP_5 KPFKF26BP_5 = 6.82E-4; // initial value of KPFKF26BP_5 KeqAK_5 = 0.45; // initial value of KeqAK_5 KiPFKATP_5 = 0.65; // initial value of KiPFKATP_5 KmPFKATP_5 = 0.71; // initial value of KmPFKATP_5 KmPFKF6P_5 = 0.1; // initial value of KmPFKF6P_5 Lzero_5 = 0.66; // initial value of Lzero_5 SUMAXP_5 = 4.1; // initial value of SUMAXP_5 gR_5 = 5.12; // initial value of gR_5 vADH_KeqADH_15 = 6.9E-5; // initial value of vADH_KeqADH_15 vADH_KiADHACE_15 = 1.1; // initial value of vADH_KiADHACE_15 vADH_KiADHETOH_15 = 90.0; // initial value of vADH_KiADHETOH_15 vADH_KiADHNADH_15 = 0.031; // initial value of vADH_KiADHNADH_15 vADH_KiADHNAD_15 = 0.92; // initial value of vADH_KiADHNAD_15 vADH_KmADHACE_15 = 1.11; // initial value of vADH_KmADHACE_15 vADH_KmADHETOH_15 = 17.0; // initial value of vADH_KmADHETOH_15 vADH_KmADHNADH_15 = 0.11; // initial value of vADH_KmADHNADH_15 vADH_KmADHNAD_15 = 0.17; // initial value of vADH_KmADHNAD_15 vADH_VmADH_15 = 810.0; // initial value of vADH_VmADH_15 vALD_KeqALD_6 = 0.069; // initial value of vALD_KeqALD_6 vALD_KeqTPI_6 = 0.045; // initial value of vALD_KeqTPI_6 vALD_KmALDDHAP_6 = 2.4; // initial value of vALD_KmALDDHAP_6 vALD_KmALDF16P_6 = 0.3; // initial value of vALD_KmALDF16P_6 vALD_KmALDGAP_6 = 2.0; // initial value of vALD_KmALDGAP_6 vALD_KmALDGAPi_6 = 10.0; // initial value of vALD_KmALDGAPi_6 vALD_VmALD_6 = 321.3; // initial value of vALD_VmALD_6 vATP_KATPASE_17 = 33.7; // initial value of vATP_KATPASE_17 vATP_KeqAK_17 = 0.45; // initial value of vATP_KeqAK_17 vATP_SUMAXP_17 = 4.1; // initial value of vATP_SUMAXP_17 vENO_KeqENO_10 = 6.7; // initial value of vENO_KeqENO_10 vENO_KmENOP2G_10 = 0.04; // initial value of vENO_KmENOP2G_10 vENO_KmENOPEP_10 = 0.5; // initial value of vENO_KmENOPEP_10 vENO_VmENO_10 = 364.5; // initial value of vENO_VmENO_10 vG3PDH_KeqG3PDH_16 = 4300.0; // initial value of vG3PDH_KeqG3PDH_16 vG3PDH_KeqTPI_16 = 0.045; // initial value of vG3PDH_KeqTPI_16 vG3PDH_KmG3PDHDHAP_16 = 0.4; // initial value of vG3PDH_KmG3PDHDHAP_16 vG3PDH_KmG3PDHGLY_16 = 1.0; // initial value of vG3PDH_KmG3PDHGLY_16 vG3PDH_KmG3PDHNADH_16 = 0.023; // initial value of vG3PDH_KmG3PDHNADH_16 vG3PDH_KmG3PDHNAD_16 = 0.93; // initial value of vG3PDH_KmG3PDHNAD_16 vG3PDH_VmG3PDH_16 = 70.2; // initial value of vG3PDH_VmG3PDH_16 vGAPDH_KeqTPI_7 = 0.045; // initial value of vGAPDH_KeqTPI_7 vGAPDH_KmGAPDHBPG_7 = 0.0098; // initial value of vGAPDH_KmGAPDHBPG_7 vGAPDH_KmGAPDHGAP_7 = 0.21; // initial value of vGAPDH_KmGAPDHGAP_7 vGAPDH_KmGAPDHNADH_7 = 0.06; // initial value of vGAPDH_KmGAPDHNADH_7 vGAPDH_KmGAPDHNAD_7 = 0.09; // initial value of vGAPDH_KmGAPDHNAD_7 vGAPDH_VmGAPDHf_7 = 1188.0; // initial value of vGAPDH_VmGAPDHf_7 vGAPDH_VmGAPDHr_7 = 6561.0; // initial value of vGAPDH_VmGAPDHr_7 vGLK_KeqAK_1 = 0.45; // initial value of vGLK_KeqAK_1 vGLK_KeqGLK_1 = 3800.0; // initial value of vGLK_KeqGLK_1 vGLK_KmGLKADP_1 = 0.23; // initial value of vGLK_KmGLKADP_1 vGLK_KmGLKATP_1 = 0.15; // initial value of vGLK_KmGLKATP_1 vGLK_KmGLKG6P_1 = 30.0; // initial value of vGLK_KmGLKG6P_1 vGLK_KmGLKGLCi_1 = 0.08; // initial value of vGLK_KmGLKGLCi_1 vGLK_SUMAXP_1 = 4.1; // initial value of vGLK_SUMAXP_1 vGLK_VmGLK_1 = 226.8; // initial value of vGLK_VmGLK_1 vGLT_KeqGLT_14 = 1.0; // initial value of vGLT_KeqGLT_14 vGLT_KmGLTGLCi_14 = 1.1918; // initial value of vGLT_KmGLTGLCi_14 vGLT_KmGLTGLCo_14 = 1.1918; // initial value of vGLT_KmGLTGLCo_14 vGLT_VmGLT_14 = 97.2; // initial value of vGLT_VmGLT_14 vGLYCO_KGLYCOGEN_3 = 6.0; // initial value of vGLYCO_KGLYCOGEN_3 vPDC_KmPDCPYR_12 = 4.33; // initial value of vPDC_KmPDCPYR_12 vPDC_VmPDC_12 = 175.5; // initial value of vPDC_VmPDC_12 vPDC_nPDC_12 = 1.9; // initial value of vPDC_nPDC_12 vPFK_VmPFK_5 = 183.6; // initial value of vPFK_VmPFK_5 vPGI_KeqPGI_2 = 0.314; // initial value of vPGI_KeqPGI_2 vPGI_KmPGIF6P_2 = 0.3; // initial value of vPGI_KmPGIF6P_2 vPGI_KmPGIG6P_2 = 1.4; // initial value of vPGI_KmPGIG6P_2 vPGI_VmPGI_2 = 340.2; // initial value of vPGI_VmPGI_2 vPGK_KeqAK_8 = 0.45; // initial value of vPGK_KeqAK_8 vPGK_KeqPGK_8 = 3200.0; // initial value of vPGK_KeqPGK_8 vPGK_KmPGKADP_8 = 0.2; // initial value of vPGK_KmPGKADP_8 vPGK_KmPGKATP_8 = 0.3; // initial value of vPGK_KmPGKATP_8 vPGK_KmPGKBPG_8 = 0.0030; // initial value of vPGK_KmPGKBPG_8 vPGK_KmPGKP3G_8 = 0.53; // initial value of vPGK_KmPGKP3G_8 vPGK_SUMAXP_8 = 4.1; // initial value of vPGK_SUMAXP_8 vPGK_VmPGK_8 = 1296.0; // initial value of vPGK_VmPGK_8 vPGM_KeqPGM_9 = 0.19; // initial value of vPGM_KeqPGM_9 vPGM_KmPGMP2G_9 = 0.1; // initial value of vPGM_KmPGMP2G_9 vPGM_KmPGMP3G_9 = 1.2; // initial value of vPGM_KmPGMP3G_9 vPGM_VmPGM_9 = 2538.0; // initial value of vPGM_VmPGM_9 vPYK_KeqAK_11 = 0.45; // initial value of vPYK_KeqAK_11 vPYK_KeqPYK_11 = 6500.0; // initial value of vPYK_KeqPYK_11 vPYK_KmPYKADP_11 = 0.53; // initial value of vPYK_KmPYKADP_11 vPYK_KmPYKATP_11 = 1.5; // initial value of vPYK_KmPYKATP_11 vPYK_KmPYKPEP_11 = 0.14; // initial value of vPYK_KmPYKPEP_11 vPYK_KmPYKPYR_11 = 21.0; // initial value of vPYK_KmPYKPYR_11 vPYK_SUMAXP_11 = 4.1; // initial value of vPYK_SUMAXP_11 vPYK_VmPYK_11 = 1093.5; // initial value of vPYK_VmPYK_11 vSUC_KSUCC_13 = 21.4; // initial value of vSUC_KSUCC_13 vTreha_KTREHALOSE_4 = 2.4; // initial value of vTreha_KTREHALOSE_4 } /* * Model variables initial values */ protected double _extracellular_GLCo_; protected double _extracellular_cytosol_; protected double _extracellular_cytosol_CO2_; protected double _extracellular_cytosol_ETOH_; protected double _extracellular_cytosol_GLY_; protected double _extracellular_cytosol_Glyc_; protected double _extracellular_cytosol_SUCC_; protected double _extracellular_cytosol_Trh_; protected double rate_vADH; protected double rate_vALD; protected double rate_vATP; protected double rate_vENO; protected double rate_vG3PDH; protected double rate_vGAPDH; protected double rate_vGLK; protected double rate_vGLT; protected double rate_vGLYCO; protected double rate_vPDC; protected double rate_vPFK; protected double rate_vPGI; protected double rate_vPGK; protected double rate_vPGM; protected double rate_vPYK; protected double rate_vSUC; protected double rate_vTreha; protected double extracellular; protected double CPFKAMP_5; protected double CPFKATP_5; protected double CPFKF16BP_5; protected double CPFKF26BP_5; protected double CiPFKATP_5; protected double F26BP_5; protected double KPFKAMP_5; protected double KPFKF16BP_5; protected double KPFKF26BP_5; protected double KeqAK_5; protected double KiPFKATP_5; protected double KmPFKATP_5; protected double KmPFKF6P_5; protected double L_PFK; protected double Lambda1; protected double Lambda2; protected double Lzero_5; protected double R_PFK; protected double SUMAXP_5; protected double T_PFK; protected double gR_5; protected double vADH_KeqADH_15; protected double vADH_KiADHACE_15; protected double vADH_KiADHETOH_15; protected double vADH_KiADHNADH_15; protected double vADH_KiADHNAD_15; protected double vADH_KmADHACE_15; protected double vADH_KmADHETOH_15; protected double vADH_KmADHNADH_15; protected double vADH_KmADHNAD_15; protected double vADH_VmADH_15; protected double vALD_KeqALD_6; protected double vALD_KeqTPI_6; protected double vALD_KmALDDHAP_6; protected double vALD_KmALDF16P_6; protected double vALD_KmALDGAP_6; protected double vALD_KmALDGAPi_6; protected double vALD_VmALD_6; protected double vATP_KATPASE_17; protected double vATP_KeqAK_17; protected double vATP_SUMAXP_17; protected double vENO_KeqENO_10; protected double vENO_KmENOP2G_10; protected double vENO_KmENOPEP_10; protected double vENO_VmENO_10; protected double vG3PDH_KeqG3PDH_16; protected double vG3PDH_KeqTPI_16; protected double vG3PDH_KmG3PDHDHAP_16; protected double vG3PDH_KmG3PDHGLY_16; protected double vG3PDH_KmG3PDHNADH_16; protected double vG3PDH_KmG3PDHNAD_16; protected double vG3PDH_VmG3PDH_16; protected double vGAPDH_KeqTPI_7; protected double vGAPDH_KmGAPDHBPG_7; protected double vGAPDH_KmGAPDHGAP_7; protected double vGAPDH_KmGAPDHNADH_7; protected double vGAPDH_KmGAPDHNAD_7; protected double vGAPDH_VmGAPDHf_7; protected double vGAPDH_VmGAPDHr_7; protected double vGLK_KeqAK_1; protected double vGLK_KeqGLK_1; protected double vGLK_KmGLKADP_1; protected double vGLK_KmGLKATP_1; protected double vGLK_KmGLKG6P_1; protected double vGLK_KmGLKGLCi_1; protected double vGLK_SUMAXP_1; protected double vGLK_VmGLK_1; protected double vGLT_KeqGLT_14; protected double vGLT_KmGLTGLCi_14; protected double vGLT_KmGLTGLCo_14; protected double vGLT_VmGLT_14; protected double vGLYCO_KGLYCOGEN_3; protected double vPDC_KmPDCPYR_12; protected double vPDC_VmPDC_12; protected double vPDC_nPDC_12; protected double vPFK_VmPFK_5; protected double vPGI_KeqPGI_2; protected double vPGI_KmPGIF6P_2; protected double vPGI_KmPGIG6P_2; protected double vPGI_VmPGI_2; protected double vPGK_KeqAK_8; protected double vPGK_KeqPGK_8; protected double vPGK_KmPGKADP_8; protected double vPGK_KmPGKATP_8; protected double vPGK_KmPGKBPG_8; protected double vPGK_KmPGKP3G_8; protected double vPGK_SUMAXP_8; protected double vPGK_VmPGK_8; protected double vPGM_KeqPGM_9; protected double vPGM_KmPGMP2G_9; protected double vPGM_KmPGMP3G_9; protected double vPGM_VmPGM_9; protected double vPYK_KeqAK_11; protected double vPYK_KeqPYK_11; protected double vPYK_KmPYKADP_11; protected double vPYK_KmPYKATP_11; protected double vPYK_KmPYKPEP_11; protected double vPYK_KmPYKPYR_11; protected double vPYK_SUMAXP_11; protected double vPYK_VmPYK_11; protected double vSUC_KSUCC_13; protected double vTreha_KTREHALOSE_4; public double[] extendResult(double time,double [] x) { this.time = time; __internalVarInitFunc_0(time, x); double[] y = new double[19]; y[0] = x[0]; y[1] = x[1]; y[2] = x[2]; y[3] = x[3]; y[4] = x[4]; y[5] = x[5]; y[6] = x[6]; y[7] = x[7]; y[8] = x[8]; y[9] = x[9]; y[10] = x[10]; y[11] = x[11]; y[12] = x[12]; y[13] = x[13]; y[14] = L_PFK; y[15] = Lambda1; y[16] = Lambda2; y[17] = R_PFK; y[18] = T_PFK; return y; } public double[] getInitialValues() { double [] x = new double[14]; this.time = 0.0; x[0] = 0.17; // - $"extracellular.cytosol.ACE" x[1] = 0.0; // - $"extracellular.cytosol.BPG" x[2] = 5.51; // - $"extracellular.cytosol.F16P" x[3] = 0.62; // - $"extracellular.cytosol.F6P" x[4] = 2.45; // - $"extracellular.cytosol.G6P" x[5] = 0.087; // - $"extracellular.cytosol.GLCi" x[6] = 1.2; // - $"extracellular.cytosol.NAD" x[7] = 0.39; // - $"extracellular.cytosol.NADH" x[8] = 6.31; // - $"extracellular.cytosol.P" x[9] = 0.12; // - $"extracellular.cytosol.P2G" x[10] = 0.9; // - $"extracellular.cytosol.P3G" x[11] = 0.07; // - $"extracellular.cytosol.PEP" x[12] = 1.85; // - $"extracellular.cytosol.PYR" x[13] = 0.96; // - $"extracellular.cytosol.TRIO" __internalVarInitFunc_0(time, x); __internalRateVarInitFunc_0(time, x); return x; } /* * code for algebraic rules calculations */ /* * end of code for algebraic rules calculations */ protected void calculateRates(double time, double[] x) { __internalVarInitFunc_0(time, x); __internalRateVarInitFunc_0(time, x); } /* * calculate dy/dt for 'BIOMD0000000064.xml' model */ public void __internalDyDt_0(double time, double [] x, double[] result) { result[0] = -rate_vADH+rate_vPDC-rate_vSUC*2; result[1] = +rate_vGAPDH-rate_vPGK; result[2] = -rate_vALD+rate_vPFK; result[3] = -rate_vPFK+rate_vPGI; result[4] = +rate_vGLK-rate_vGLYCO-rate_vPGI-rate_vTreha*2; result[5] = -rate_vGLK+rate_vGLT; result[6] = +rate_vADH+rate_vG3PDH-rate_vGAPDH-rate_vSUC*3; result[7] = -rate_vADH-rate_vG3PDH+rate_vGAPDH+rate_vSUC*3; result[8] = -rate_vATP-rate_vGLK-rate_vGLYCO-rate_vPFK+rate_vPGK+rate_vPYK-rate_vSUC*4-rate_vTreha; result[9] = -rate_vENO+rate_vPGM; result[10] = +rate_vPGK-rate_vPGM; result[11] = +rate_vENO-rate_vPYK; result[12] = -rate_vPDC+rate_vPYK; result[13] = +rate_vALD*2-rate_vG3PDH-rate_vGAPDH; } protected double [] calculateResult(double time, double[] x) { double[] result = new double[14]; __internalDyDt_0(time, x, result); return result; } public double[] dy_dt(double time, double[] x) { this.time = time; calculateRates( time,x ); return calculateResult( time,x ); } } // class ...