AUC= INTEG ( (S2+R2/100)/140, 0) ~ mg*Minute [0,?] ~ AUC: Area Under the Curve | R1= INTEG ( -Rr, 1-"S-RS") ~ mg [0,?] ~ Menge R-Isomer im Verdauungstrakt | S1= INTEG ( -Sr, "S-RS") ~ mg [0,?] ~ Menge S-Isomer im Verdauungstrakt | krr= LN(2)/HWZr ~ 1/Minute [0,?] ~ Reaktionsgeschwindigkeits-Konstante der Resorption | kse= LN(2)/HWZe*87/57 ~ 1/Minute [0,?] ~ Reaktionsgeschwindigkeits-Konstante der Elimination des S-Isomers | HWZr= 60 ~ Minute [20,90] ~ Die Aufnahme ist langsamer nach dem Essen. Die Aufnahme von Salzen mit \ Lysin sind. z.B. rascher. | ksr= LN(2)/HWZr ~ 1/Minute [0,?] ~ Reaktionsgeschwindigkeits-Konstante der Resorption | HWZe= 147 ~ Minute [120,180] ~ Halbwertszeit der Elimination, S wird rascher ausgeschieden als R | kre= LN(2)/HWZe ~ 1/Minute [0,?] ~ Reaktionsgeschwindigkeits-Konstante der Elimination des R-Isomers | HWZi= 180 ~ Minute [60,240] ~ Inversion; es wurde eine Halbwertszeit von 5 Stunden gefunden, die jedoch \ wegen der Elimination unrealistisch erscheint, daher ist hier die \ realistischere Messung von 1.5 Stunden verwendet worden. | ki= LN(2)/HWZi ~ 1/Minute [0,?] ~ Reaktionsgeschwindigkeits-Konstante der Inversion R-> S | "S-RS"= 1 ~ mg [0.5,1] ~ Reines S-Isomer=1, reines Racemat 0.5 | RSi= -ki*R2 ~ mg/Minute ~ | R2= INTEG ( +Rr+RSi-Re, 0) ~ mg [0,?] ~ Menge R-Isomer im Blut | Re= kre*R2 ~ mg/Minute ~ | Rr= krr*R1 ~ mg/Minute ~ | S2= INTEG ( +Sr-RSi-Se, 0) ~ mg [0,?] ~ Menge S-Isomer im Blut | Se= kse*S2 ~ mg/Minute ~ | Sr= ksr*S1 ~ mg/Minute ~ | ******************************************************** .Control ********************************************************~ Simulation Control Parameters | FINAL TIME = 480 ~ Minute ~ The final time for the simulation. | INITIAL TIME = 0 ~ Minute ~ The initial time for the simulation. | SAVEPER = 1 ~ Minute [0,?] ~ The frequency with which output is stored. | TIME STEP = 0.1 ~ Minute [0,?] ~ The time step for the simulation. | \\\---/// Sketch information - do not modify anything except names V300 Do not put anything below this section - it will be ignored *View 1 $192-192-192,0,Times New Roman|12||0-0-0|0-0-0|0-0-255|-1--1--1|-1--1--1|120,120,100 10,1,R1,278,136,40,20,3,3,0,0,0,0,0,0 10,2,S1,280,261,40,20,3,3,0,0,0,0,0,0 10,3,R2,474,136,40,20,3,3,0,0,0,0,0,0 10,4,S2,480,258,40,20,3,3,0,0,0,0,0,0 1,5,7,3,36,0,0,22,2,0,0,-1--1--1,|12||0-0-0,1|(477,173)| 1,6,7,4,68,0,0,22,2,0,0,-1--1--1,|12||0-0-0,1|(477,220)| 11,7,220,477,197,8,6,33,3,0,0,4,0,0,0 10,8,RSi,504,197,19,12,40,3,0,0,-1,0,0,0 1,9,11,3,4,0,0,22,0,0,0,-1--1--1,,1|(408,136)| 1,10,11,1,100,0,0,22,0,0,0,-1--1--1,,1|(344,136)| 11,11,524,376,136,6,8,34,3,0,0,1,0,0,0 10,12,Rr,376,156,19,12,40,3,0,0,-1,0,0,0 1,13,15,4,4,0,0,22,0,0,0,-1--1--1,,1|(411,261)| 1,14,15,2,100,0,0,22,0,0,0,-1--1--1,,1|(345,261)| 11,15,300,377,261,6,8,34,3,0,0,1,0,0,0 10,16,Sr,377,281,17,12,40,3,0,0,-1,0,0,0 12,17,48,652,136,10,8,0,3,0,0,-1,0,0,0 1,18,20,17,4,0,0,22,0,0,0,-1--1--1,,1|(613,136)| 1,19,20,3,100,0,0,22,0,0,0,-1--1--1,,1|(543,136)| 11,20,48,578,136,6,8,34,3,0,0,1,0,0,0 10,21,Re,578,156,13,12,40,3,0,0,-1,0,0,0 12,22,48,651,263,10,8,0,3,0,0,-1,0,0,0 1,23,25,22,4,0,0,22,0,0,0,-1--1--1,,1|(612,263)| 1,24,25,4,100,0,0,22,0,0,0,-1--1--1,,1|(545,263)| 11,25,48,577,263,6,8,34,3,0,0,1,0,0,0 10,26,Se,577,283,12,12,40,3,0,0,-1,0,0,0 1,27,3,20,1,0,0,0,0,64,0,-1--1--1,,1|(538,92)| 1,28,4,25,1,0,0,0,0,64,0,-1--1--1,,1|(541,230)| 1,29,3,7,1,0,0,0,0,64,0,-1--1--1,,1|(430,175)| 1,30,1,11,1,0,0,0,0,64,0,-1--1--1,,1|(342,92)| 1,31,2,15,1,0,0,0,0,64,0,-1--1--1,,1|(340,231)| 10,32,ki,372,200,24,12,8,131,0,0,0,0,0,0 10,33,krr,312,59,17,12,8,3,0,0,0,0,0,0 10,34,ksr,302,318,33,13,8,131,0,0,0,0,0,0 10,35,kse,501,326,16,12,8,3,0,0,0,0,0,0 10,36,kre,508,55,15,12,8,3,0,0,0,0,0,0 1,37,36,20,1,0,0,0,0,64,0,-1--1--1,,1|(571,78)| 1,38,35,26,1,0,0,0,0,64,0,-1--1--1,,1|(547,325)| 1,39,34,16,1,0,0,0,0,64,0,-1--1--1,,1|(359,321)| 1,40,33,11,1,0,0,0,0,64,0,-1--1--1,,1|(373,90)| 1,41,32,7,1,0,0,0,0,64,0,-1--1--1,,1|(462,200)| 12,42,0,841,748,40,20,8,0,0,0,-1,0,0,0 10,43,HWZi,313,176,27,12,8,3,0,0,0,0,0,0 1,44,43,32,1,0,0,0,0,64,0,-1--1--1,,1|(345,215)| 10,45,"S-RS",137,257,23,12,8,3,0,0,0,0,0,0 10,46,HWZe,420,75,32,12,8,3,0,0,0,0,0,0 1,47,46,36,1,0,0,0,0,64,0,-1--1--1,,1|(459,51)| 1,48,46,35,1,0,0,0,0,64,0,-1--1--1,,1|(436,284)| 10,49,HWZr,188,202,27,12,8,3,0,0,0,0,0,0 1,50,49,33,1,0,0,0,0,64,0,-1--1--1,,1|(227,106)| 1,51,49,34,1,0,0,0,0,64,0,-1--1--1,,1|(235,293)| 10,52,AUC,665,200,58,25,3,131,0,0,0,0,0,0 1,53,4,52,1,0,0,0,0,64,0,-1--1--1,,1|(541,214)| 1,54,3,52,1,0,0,0,0,64,0,-1--1--1,,1|(552,185)| 1,57,45,1,0,1,0,0,0,64,1,-1--1--1,,1|(196,205)| 1,58,45,2,0,1,0,0,0,64,1,-1--1--1,,1|(193,257)| ///---\\\ :GRAPH GRAPH :TITLE AUC :X-AXIS Time :SCALE :VAR S2|S-Form :Y-MIN 0 :Y-MAX 0.5 :DATASET S-Form :VAR R2|Racemat :Y-MIN 0 :Y-MAX 0.5 :DATASET Racemat :L<%^E!@ 1:S-Isomer.vdf 1:Racemat.vdf 9:S-Isomer 23:0 15:0,0,0,0,0,0 19:100,0 27:2, 34:0, 4:Time 5:S2 24:0 25:480.02 26:480.02