# XPP has its own rule of naming parameters, so the parameter names in this code might be different from those in the paper. # Equations of PKA and ERK dynamics are same as the ones in Nature Neuroscience paper pRaf'=(K_fRaf*(delay(5HT, 25)))*Raf-K_bRaf*pRaf Raf=Raf_total-pRaf MAPKK'=-K_fMAPKK*pRaf*(MAPKK/(MAPKK+K_1mkk))+K_bMAPKK*(pMAPKK/(pMAPKK+K_2mkk)) ppMAPKK'=K_fMAPKK*pRaf*(pMAPKK/(pMAPKK+K_1mkk))-K_bMAPKK*(ppMAPKK/(ppMAPKK+K_2mkk)) pMAPKK=MAPKK_tt-MAPKK-ppMAPKK MAPK'=-K_fMAPK*ppMAPKK*(MAPK/(MAPK+K_1mk))+K_bMAPK*(pMAPK/(pMAPK+K_2mk)) ppMAPK'=K_fMAPK*ppMAPKK*(pMAPK/(pMAPK+K_1mk))-K_bMAPK*(ppMAPK/(ppMAPK+K_2mk)) pMAPK=MAPK_tt-ppMAPK-MAPK cAMP'=lamda*(5HT/(5HT+K_5HT))-K_bcamp*cAMP PKAR'=K_fpka*PKARC*cAMP^2-K_bpka*PKAR*PKAC PKARC'=-K_fpka*PKARC*cAMP^2+K_bpka*PKAR*PKAC PKAC'=K_fpka*PKARC*cAMP^2-K_bpka*PKAR*PKAC p K_fRaf=0.004 p K_bRaf=0.1 p Raf_total=0.5 p K_fMAPKK=0.41 p K_bMAPKK=0.04 p K_1mkk=0.20 p K_2mkk=0.19 p MAPKK_tt=0.5 p K_fMAPK=0.41 p K_bMAPK=0.12 p K_1mk=0.19 p K_2mk=0.21 p MAPK_tt=0.5 p lamda=3.64 p K_bcamp=1 p K_5HT=85 p K_fpka=20 p K_bpka=12 # PKACA is the activity of PKA, calculated in the way as described in Muller and Carew 1998. # 3.8 is the maximal PKAC. PKACA=PKAC/3.8 inducer=PKACA*ppMAPK init pRaf=0 init MAPKK=0.5 init ppMAPKK=0 init MAPK=0.5 init PPMAPK=0 init PKAC=0 init cAMP=0 init PKAR=0 init PKARC=4 # the following are the equations of CREB1, CREB2, and CEBP #phosphorylated CREB1 protein pCREB1'=K_phosC1*PKACA*CREB1-K_dephC1*pCREB1 #phosphorylated CREB2 protein pCREB2'=K_phosC2*ppMAPK*CREB2-K_dephC2*pCREB2 CREB1=0.05-pCREB1 CREB2=0.05-pCREB2 p K_phosC1=0.15 p K_dephC1=0.05 p K_phosC2=3.5 p K_dephC2=0.5 #synthesis OF CEBP protein CEBP'=((V_xCBP*((f5^2/K_xCBP)/(1+f5^2/K_xCBP+f6^2/K_yCBP)))-K_dxCBP*CEBP)-(K_phosC3*ppMAPK*CEBP-K_dephC3*pCEBP) #phosphorylated CEBP protein pCEBP'=(K_phosC3*ppMAPK*CEBP-K_dephC3*pCEBP-K_dZ2*pCEBP) f5=pCREB1 f6=CREB2 # CBP would be reduced to 0.65 when CBP knockdown was simulated. CBP=1 # we do not know the binding affinity of CBP, so we actually tried different Kcbp, ranging from 1 to 20. # We found that varying Kcbp did not change the rank of the Rescue Protocol in 10000 protocols, which always ended up as the one with highest peak pCEBP. # Varying Kcbp, we got different numbers of potential rescue protocols. The maximum number of potential rescue protocols we got was 421. Kcbp=20 v_xCBP=20*(CBP/(Kcbp+CBP)) # parameters K5 and K6 in J Neurosci. paper are the square root of K_xCBP and K_yCBP. p K_xCBP=0.00009 p K_yCBP=0.00001 p K_dxCBP=0.075 p K_dZ2=0.0015 p K_phosC3=0.25 p K_dephC3=0.5 #init pCREB1, pCREB2, CEBP init pCREB1=0 init pCREB2=0 init CEBP=0 # 5 pulses of 5-HT 5HT'=50*(on0*heav(t-t2)*heav(t2+5-t)+on1*heav(t-t2-inter1)*heav(inter1+5+t2-t)+on2*heav(t-t2-inter1-inter2)*heav(inter1+inter2+5+t2-t)+on3*heav(t-t2-inter1-inter2-inter3)*heav(inter1+inter2+inter3+5+t2-t)+on4*heav(t-t2-inter1-inter2-inter3-inter4)*heav(inter1+inter2+inter3+inter4+5+t2-t))*turnon-5HT # calculation of ISIs inter1=5*(1+a1) inter2=5*(1+a2) inter3=5*(1+a3) inter4=5*(1+a4) # on0 - on4 control how many pulses of 5-HT we will use p on0=1 p on1=1 p on2=1 p on3=1 p on4=1 p turnon=1 p t1=2995 p t2=2910 aux 1=(t-t2) aux 4=5HT aux 7=a1 aux 8=a2 aux 9=a3 aux 10=a4 aux 13=inducer aux 14=PKACA aux 15=ppMAPK auX 17=CEBP+pCEBP aux 18=pCEBP p step=1131 # This is how we code 10,000 protocols a4=(step-10*flr(step/10)) a3=flr((step-100*flr(step/100))/10) a2=flr((step-1000*flr(step/1000))/100) a1=flr(step/1000) @ total=4000, xlo=0, xhi=5000, ylo=0, yhi=10, bounds=10e30, MAXSTOR=1300000,xp=vs, yp=mk,nout=250, dt=0.01, @ delay=6000 #@ output=test.txt # This is how we run 10,000 simulations. @ RANGE=1, RANGEOVER=step, RANGESTEP=10000, RANGELOW=0, RANGEHIGH=10000, RANGERESET=yes, RANGEOLDIC=yes, output=test