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升级   87.37% TA的每日心情 | 无聊 2015-10-10 18:19 |
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签到天数: 24 天 [LV.4]偶尔看看III
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10体力
function parafit; g( v% y( g5 E, `( ?' q' A' {( f' W5 M
% k1->k-1,k2->k1,k3->k2,k4->k3,k5->k4
5 H2 g6 v7 U# K9 R; {& g! T% k6->k6 k7->k7
0 A+ Y: ^: |! v% dGlcdt = k-1*C(Fru)-(k1+k2)*C(Glc);! B! j, n) N% s8 {; |. G
% dFrudt = k1*C(Glc)-(k-1+k3+k4)C(Fru);
& Y0 L& w- Z! `- Y) i, o$ B% dFadt = k(2)*C(Glc)+k4*C(Fru)+(k6+k7)*C(Hmf);
9 Y/ [ T2 F; M6 r" R4 ?2 |7 l% dLadt = k(7)*C(Hmf);
6 }' ?! e4 P/ d7 o%dHmfdt = k(3)*C(Fru)-(k6+k7)*C(Hmf);, _! D- z5 J) ]
clear all! Z% J; I, Q+ \/ I
clc
# g( N8 |7 e7 F- A1 }format long: \8 A. a2 b, n$ g! {& V
% t/min Glc Fru Fa La HMF/ mol/L : a, P; Y* j. Q( j: ]. M8 y! F
Kinetics=[0 0.25 0 0 0 0
/ y/ p a! P) u8 b# Q 15 0.2319 0.01257 0.0048 0 2.50E-04% t/ w5 X; n' Q8 }9 F$ S* s- l
30 0.19345 0.027 0.00868 0 7.00E-04
5 o9 G2 A( g7 A8 t2 n7 c8 ` 45 0.15105 0.06975 0.02473 0 0.0033
# C$ f. x- L. N* G3 h9 V 60 0.13763 0.07397 0.02615 0 0.00428, U9 d+ }0 @+ }3 u! s
90 0.08115 0.07877 0.07485 0 0.01405+ X4 d# e9 O2 c2 l) o
120 0.0656 0.07397 0.07885 0.00573 0.02143( l; w' W" w0 ~+ i' r
180 0.04488 0.0682 0.07135 0.0091 0.03623) [- F! L# ?$ Q( T% Y1 a
240 0.03653 0.06488 0.08945 0.01828 0.05452) w* C" U' p; U, Z$ t# _
300 0.02738 0.05448 0.09098 0.0227 0.0597
2 B; H* S8 o; C) B 360 0.01855 0.04125 0.09363 0.0239 0.06495];
% T" P5 t& E0 O6 B2 N' bk0 = [0.0000000005 0.0000000005 0.0000000005 0.00000000005 0.00005 0.0134 0.00564 0.00001 0.00001 0.00001]; % 参数初值 n. m) z- j1 M: o) s* o) ]
lb = [0 0 0 0 0 0 0 0 0 0]; % 参数下限
; K8 D+ W" Q; i" Y- Y+ ~ub = [1 1 1 1 1 1 1 1 1 1]; % 参数上限
7 d% m5 o4 F2 i& _. Y' Kx0 = [0.25 0 0 0 0];' F8 \) k6 Z( }$ w
yexp = Kinetics; % yexp: 实验数据[x1 x4 x5 x6]2 U8 \) l, k9 M6 O+ z3 P
% warning off
& z; z- t2 A$ R. \0 V& K* c/ Q3 A- m% 使用函数 ()进行参数估计
% z( a8 w* c' ?[k,fval,flag] = fmincon(@ObjFunc7Fmincon,k0,[],[],[],[],lb,ub,[],[],x0,yexp);
9 r# A, \/ I! D3 ofprintf('\n使用函数fmincon()估计得到的参数值为:\n')
) p% N6 ]* R' w1 D/ H* nfprintf('\tk1 = %.11f\n',k(1))
4 o U" Y* n# B" @6 B; v+ wfprintf('\tk2 = %.11f\n',k(2))
/ c* O/ r: t/ q9 ?' b$ Y( X; m1 Kfprintf('\tk3 = %.11f\n',k(3))
- v& k8 l/ l* ~- w# ~fprintf('\tk4 = %.11f\n',k(4))8 Y. |6 V0 M) `
fprintf('\tk5 = %.11f\n',k(5))! \2 }6 @$ r- x% Z
fprintf('\tk6 = %.11f\n',k(6))
# F1 x- Y/ H0 X% ^1 ffprintf('\tk7 = %.11f\n',k(7))+ w7 { t7 H9 A* ~4 W/ D/ t: K
fprintf('\tk8 = %.11f\n',k(8)): z F. n2 k( `; {
fprintf('\tk9 = %.11f\n',k(9))
* s( U3 @5 A0 M3 Ufprintf('\tk10 = %.11f\n',k(10))
- J% Z( \( C9 I1 s; Ofprintf(' The sum of the squares is: %.1e\n\n',fval)1 x! C! `$ _' a$ O# R6 B
k_fm= k;; h. _. c; _; a0 ~8 g% `
% warning off
8 T% F- C# V$ }/ i% 使用函数lsqnonlin()进行参数估计
: u- w+ w! u9 v[k,resnorm,residual,exitflag,output,lambda,jacobian] = ...# n- ~: C) X( K$ u+ m9 P& Z2 |" h
lsqnonlin(@ObjFunc7LNL,k0,lb,ub,[],x0,yexp);
5 ]+ b1 O& A! [& d3 U/ T) Bci = nlparci(k,residual,jacobian);5 X! s) e V7 z8 {; F' `
fprintf('\n\n使用函数lsqnonlin()估计得到的参数值为:\n')
$ T# t- B6 V3 Pfprintf('\tk1 = %.11f\n',k(1))( D' `4 s# Q- h% J+ v
fprintf('\tk2 = %.11f\n',k(2)) n. n9 T4 u) f, A4 Y. f9 F- }7 D
fprintf('\tk3 = %.11f\n',k(3))/ h1 e+ E/ \% q# T
fprintf('\tk4 = %.11f\n',k(4))7 r! J9 N$ Y# f
fprintf('\tk5 = %.11f\n',k(5))
; C' W: }6 Q# {! f# [fprintf('\tk6 = %.11f\n',k(6))5 g- W" P' h4 _* V
fprintf('\tk7 = %.11f\n',k(7))& m4 b2 _: @0 W
fprintf('\tk8 = %.11f\n',k(8))' E+ [- A! z6 W, g: b) k7 Y+ a
fprintf('\tk9 = %.11f\n',k(9)) O, I/ g" Y% K3 Y( g7 A0 }
fprintf('\tk10 = %.11f\n',k(10))( g! N; D* t1 H
fprintf(' The sum of the squares is: %.1e\n\n',resnorm)0 A2 d4 F- S4 N, m' R' I" H
k_ls = k;
* o: L9 H4 K8 G6 X; coutput* j2 L O3 D$ P' @% l3 A6 S4 v
warning off
* F3 \1 G6 c# n3 d4 o% 以函数fmincon()估计得到的结果为初值,使用函数lsqnonlin()进行参数估计0 [0 W- H& h7 m! U+ b
k0 = k_fm;! l$ B) L/ k2 M: v
[k,resnorm,residual,exitflag,output,lambda,jacobian] = ...8 `6 }7 z" |& e g* k! z3 {
lsqnonlin(@ObjFunc7LNL,k0,lb,ub,[],x0,yexp);
" S" k" q+ L" y0 h! oci = nlparci(k,residual,jacobian);
$ B+ Y5 |) x, O9 D5 N9 c6 Yfprintf('\n\n以fmincon()的结果为初值,使用函数lsqnonlin()估计得到的参数值为:\n')9 a$ s0 R. ~% V8 \& e' }8 [0 R
fprintf('\tk1 = %.11f\n',k(1)) b( D9 S( `' h/ V1 z1 u
fprintf('\tk2 = %.11f\n',k(2))
8 {! j' G: n% n1 P6 m2 t3 efprintf('\tk3 = %.11f\n',k(3))# q5 a& H* C4 a9 M, F# \3 Q, |
fprintf('\tk4 = %.11f\n',k(4))
) k) h9 A8 O4 d* F+ o7 [fprintf('\tk5 = %.11f\n',k(5))
! {" k' r9 E1 M- W1 G" Q, Efprintf('\tk6 = %.11f\n',k(6))
' O9 {! B: h8 U3 f; s; Cfprintf('\tk7 = %.11f\n',k(7))* u, n3 t' @$ d }6 ^4 x
fprintf('\tk8 = %.11f\n',k(8)). R7 {! f2 G5 q- R8 {
fprintf('\tk9 = %.11f\n',k(9))2 }8 E$ n' ^; j/ i+ z
fprintf('\tk10 = %.11f\n',k(10))
4 O# [; e" N# Q ^/ W* t5 Gfprintf(' The sum of the squares is: %.1e\n\n',resnorm)7 _5 {* W+ g/ ]% S) R
k_fmls = k; C- t6 K9 A& @* a6 s
output
9 a4 K# }$ ^4 a& S1 ltspan = [0 15 30 45 60 90 120 180 240 300 360];1 t+ C* O/ j! T% U$ y
[t x] = ode45(@KineticEqs,tspan,x0,[],k_fmls); 9 W5 P" Y7 O2 O
figure;
0 e( `' b$ F+ n. T$ f; D* _9 mplot(t,x(:,1),t,yexp(:,2),'*');legend('Glc-pr','Glc-real')
% [8 W- T% ~! X6 T) hfigure;plot(t,x(:,2:5));5 O2 F( k% H9 z6 d
p=x(:,1:5)
p/ q0 w- H1 @6 }" D3 z6 ]$ s4 Whold on
! b3 H o8 T8 B* f; Hplot(t,yexp(:,3:6),'o');legend('Fru-pr','Fa-pr','La-pr','HMF-pr','Fru-real','Fa-real','La-real','HMF-real')/ c0 {2 \& ~' t* H! \7 U
. u0 f8 H1 B) G) P/ P
# Z) |; |! O1 ], h0 t* |
6 R8 x% l1 t! F; R4 @+ ]6 V5 wfunction f = ObjFunc7LNL(k,x0,yexp)
* T' i5 R* _" [6 ]2 atspan = [0 15 30 45 60 90 120 180 240 300 360];
' }, y+ W: Z& D5 N' ]3 J8 [[t, x] = ode45(@KineticEqs,tspan,x0,[],k); ' k9 d( t4 X, O& ^
y(:,2) = x(:,1);
) F: C) Q2 ~2 R5 F. N0 L! [y(:,3:6) = x(:,2:5);5 Y2 |- W3 b F" `: B' ?
f1 = y(:,2) - yexp(:,2);
5 G) R* n/ _6 _7 h' \f2 = y(:,3) - yexp(:,3);, F' x! P" ]9 V' C
f3 = y(:,4) - yexp(:,4);: V+ ^- ]9 V+ k& u" H
f4 = y(:,5) - yexp(:,5);7 G8 i; d4 D5 y* J$ w: I5 v( }
f5 = y(:,6) - yexp(:,6);# Q, j7 z& W4 }* R/ i
f = [f1; f2; f3; f4; f5];/ ^0 K$ p0 [# A' L- h8 f
& y" g7 `5 g1 [. k3 p! B4 w- x2 K* _& `
5 O% _ N% j- j* e& x* Y: M
function f = ObjFunc7Fmincon(k,x0,yexp)& }8 n" T' J& O7 _6 ^
tspan = [0 15 30 45 60 90 120 180 240 300 360];
7 \ w B5 A( |- h9 C6 P& t[t x] = ode45(@KineticEqs,tspan,x0,[],k);
4 g* g9 x4 v0 p0 @) Py(:,2) = x(:,1);
! ?: a _) T9 P7 Vy(:,3:6) = x(:,2:5);; @% r' ^4 s( o# x$ T+ N
f = sum((y(:,2)-yexp(:,2)).^2) + sum((y(:,3)-yexp(:,3)).^2) ...
/ T! u' V1 q) B+ y, [7 W1 } + sum((y(:,4)-yexp(:,4)).^2) + sum((y(:,5)-yexp(:,5)).^2) ...9 l/ j0 U4 X# c, E. i
+ sum((y(:,6)-yexp(:,6)).^2) ;
7 g$ r8 e) o% n0 r' Z8 [
" L$ s% k7 j8 L q2 S6 U* D, \8 h
: }5 K7 r) n. S2 t# R c8 }2 o% i$ H i d0 [- e
; @: O6 c& `. O7 b
function dxdt = KineticEqs(t,x,k)% X$ Q9 V* u8 U9 Q
dGldt = k(1)*x(2)-(k(2)+k(3)+k(8))*x(1);
/ ~& _9 G2 s+ n$ ^$ jdFrdt = k(2)*x(1)-(k(1)+k(4)+k(5)+k(9))*x(2);
5 r' b" M5 [, B1 EdFadt = k(3)*x(1)+k(5)*x(2)+(k(6)+k(7))*x(5);
, Q5 j' B' G Z* fdLadt = k(7)*x(5);; z3 L$ `/ |2 g! }! A& y
dHmdt = k(4)*x(2)-(k(6)+k(7)+k(10))*x(5);
f% v$ [' L3 s/ |8 v5 f" n$ Pdxdt = [dGldt; dFrdt; dFadt; dLadt; dHmdt];
' }( |* n9 E2 D" n9 D. D$ [9 U; ^
+ W }7 G6 v" R1 s3 ?- W3 e' J+ x! k3 R6 Y
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