def model individual_CHE as def import using "units_and_constants/units_BG.cellml" for unit mM using unit mM; unit fmol using unit fmol; unit per_fmol using unit per_fmol; unit J_per_mol using unit J_per_mol; unit fmol_per_sec using unit fmol_per_sec; unit C_per_mol using unit C_per_mol; unit fF using unit fF; unit fC using unit fC; unit per_second using unit per_second; unit per_sec using unit per_sec; unit J_per_K_per_mol using unit J_per_K_per_mol; unit fmol_per_L using unit fmol_per_L; unit pL using unit pL; enddef; def import using "units_and_constants/constants_BG.cellml" for comp constants using comp constants; enddef; def comp environment as var time: second {pub: out}; // initial values var q_OH_i: fmol {init: 1e-888, pub: out}; var q_OH_o: fmol {init: 1e-888, pub: out}; var q_Cl_i: fmol {init: 1e-888, pub: out}; var q_Cl_o: fmol {init: 1e-888, pub: out}; var q_S1_CHE: fmol {init: 1e-888, pub: out}; var q_S2_CHE: fmol {init: 1e-888, pub: out}; var q_S3_CHE: fmol {init: 1e-888, pub: out}; var q_S4_CHE: fmol {init: 1e-888, pub: out}; var q_S5_CHE: fmol {init: 1e-888, pub: out}; var q_S6_CHE: fmol {init: 1e-888, pub: out}; // From submodule var v_R61_CHE: fmol_per_sec {pub: in}; var v_R12_CHE: fmol_per_sec {pub: in}; var v_R23_CHE: fmol_per_sec {pub: in}; var v_R34_CHE: fmol_per_sec {pub: in}; var v_R45_CHE: fmol_per_sec {pub: in}; var v_R56_CHE: fmol_per_sec {pub: in}; ode(q_OH_i, time) = vvv; ode(q_OH_o, time) = vvv; ode(q_Cl_i, time) = vvv; ode(q_Cl_o, time) = vvv; ode(q_S1_CHE, time) = vvv; ode(q_S2_CHE, time) = vvv; ode(q_S3_CHE, time) = vvv; ode(q_S4_CHE, time) = vvv; ode(q_S5_CHE, time) = vvv; ode(q_S6_CHE, time) = vvv; enddef; def comp CHE_parameters as var kappa_R61_CHE: fmol_per_sec {init: 8.77838, pub: out}; var kappa_R12_CHE: fmol_per_sec {init: 0.031295, pub: out}; var kappa_R23_CHE: fmol_per_sec {init: 50940.7, pub: out}; var kappa_R34_CHE: fmol_per_sec {init: 0.000192726, pub: out}; var kappa_R45_CHE: fmol_per_sec {init: 2.96501e+06, pub: out}; var kappa_R56_CHE: fmol_per_sec {init: 1.82153e+06, pub: out}; var K_OH_i: per_fmol {init: 0.0253475, pub: out}; var K_OH_o: per_fmol {init: 7203.46, pub: out}; var K_Cl_i: per_fmol {init: 0.015572, pub: out}; var K_Cl_o: per_fmol {init: 0.00442538, pub: out}; var K_S1_CHE: per_fmol {init: 28.479, pub: out}; var K_S2_CHE: per_fmol {init: 856.026, pub: out}; var K_S3_CHE: per_fmol {init: 353352, pub: out}; var K_S4_CHE: per_fmol {init: 6070.81, pub: out}; var K_S5_CHE: per_fmol {init: 0.569962, pub: out}; var K_S6_CHE: per_fmol {init: 0.4887, pub: out}; enddef; def comp CHE as var time: second {pub: in}; var R: J_per_K_per_mol {pub: in}; var T: kelvin {pub: in}; // parameters var kappa_R61_CHE: fmol_per_sec {pub: in}; var kappa_R12_CHE: fmol_per_sec {pub: in}; var kappa_R23_CHE: fmol_per_sec {pub: in}; var kappa_R34_CHE: fmol_per_sec {pub: in}; var kappa_R45_CHE: fmol_per_sec {pub: in}; var kappa_R56_CHE: fmol_per_sec {pub: in}; var K_OH_i: per_fmol {pub: in}; var K_OH_o: per_fmol {pub: in}; var K_Cl_i: per_fmol {pub: in}; var K_Cl_o: per_fmol {pub: in}; var K_S1_CHE: per_fmol {pub: in}; var K_S2_CHE: per_fmol {pub: in}; var K_S3_CHE: per_fmol {pub: in}; var K_S4_CHE: per_fmol {pub: in}; var K_S5_CHE: per_fmol {pub: in}; var K_S6_CHE: per_fmol {pub: in}; // Input from global environment var q_OH_i: fmol {pub: in}; var q_OH_o: fmol {pub: in}; var q_Cl_i: fmol {pub: in}; var q_Cl_o: fmol {pub: in}; var q_S1_CHE: fmol {pub: in}; var q_S2_CHE: fmol {pub: in}; var q_S3_CHE: fmol {pub: in}; var q_S4_CHE: fmol {pub: in}; var q_S5_CHE: fmol {pub: in}; var q_S6_CHE: fmol {pub: in}; // Constitutive parameters var mu_OH_i: J_per_mol; var mu_OH_o: J_per_mol; var mu_Cl_i: J_per_mol; var mu_Cl_o: J_per_mol; var mu_S1_CHE: J_per_mol; var mu_S2_CHE: J_per_mol; var mu_S3_CHE: J_per_mol; var mu_S4_CHE: J_per_mol; var mu_S5_CHE: J_per_mol; var mu_S6_CHE: J_per_mol; var v_R61_CHE: fmol_per_sec {pub: out}; var v_R12_CHE: fmol_per_sec {pub: out}; var v_R23_CHE: fmol_per_sec {pub: out}; var v_R34_CHE: fmol_per_sec {pub: out}; var v_R45_CHE: fmol_per_sec {pub: out}; var v_R56_CHE: fmol_per_sec {pub: out}; mu_OH_i = R*T*ln(K_OH_i*q_OH_i); mu_OH_o = R*T*ln(K_OH_o*q_OH_o); mu_Cl_i = R*T*ln(K_Cl_i*q_Cl_i); mu_Cl_o = R*T*ln(K_Cl_o*q_Cl_o); mu_S1_CHE = R*T*ln(K_S1_CHE*q_S1_CHE); mu_S2_CHE = R*T*ln(K_S2_CHE*q_S2_CHE); mu_S3_CHE = R*T*ln(K_S3_CHE*q_S3_CHE); mu_S4_CHE = R*T*ln(K_S4_CHE*q_S4_CHE); mu_S5_CHE = R*T*ln(K_S5_CHE*q_S5_CHE); mu_S6_CHE = R*T*ln(K_S6_CHE*q_S6_CHE); v_R61_CHE = kappa_R61_CHE*(ppp); v_R12_CHE = kappa_R12_CHE*(ppp); v_R23_CHE = kappa_R23_CHE*(ppp); v_R34_CHE = kappa_R34_CHE*(ppp); v_R45_CHE = kappa_R45_CHE*(ppp); v_R56_CHE = kappa_R56_CHE*(ppp); enddef; def map between environment and CHE for vars time and time; vars q_OH_i and q_OH_i; vars q_OH_o and q_OH_o; vars q_Cl_i and q_Cl_i; vars q_Cl_o and q_Cl_o; vars q_S1_CHE and q_S1_CHE; vars q_S2_CHE and q_S2_CHE; vars q_S3_CHE and q_S3_CHE; vars q_S4_CHE and q_S4_CHE; vars q_S5_CHE and q_S5_CHE; vars q_S6_CHE and q_S6_CHE; vars v_R61_CHE and v_R61_CHE; vars v_R12_CHE and v_R12_CHE; vars v_R23_CHE and v_R23_CHE; vars v_R34_CHE and v_R34_CHE; vars v_R45_CHE and v_R45_CHE; vars v_R56_CHE and v_R56_CHE; enddef; def map between CHE and CHE_parameters for vars kappa_R61_CHE and kappa_R61_CHE; vars kappa_R12_CHE and kappa_R12_CHE; vars kappa_R23_CHE and kappa_R23_CHE; vars kappa_R34_CHE and kappa_R34_CHE; vars kappa_R45_CHE and kappa_R45_CHE; vars kappa_R56_CHE and kappa_R56_CHE; vars K_OH_i and K_OH_i; vars K_OH_o and K_OH_o; vars K_Cl_i and K_Cl_i; vars K_Cl_o and K_Cl_o; vars K_S1_CHE and K_S1_CHE; vars K_S2_CHE and K_S2_CHE; vars K_S3_CHE and K_S3_CHE; vars K_S4_CHE and K_S4_CHE; vars K_S5_CHE and K_S5_CHE; vars K_S6_CHE and K_S6_CHE; enddef; def map between constants and CHE for vars R and R; vars T and T; enddef; enddef;