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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$ v% P% f% z. h+ Q* ^/ h6 r
% k1->k-1,k2->k1,k3->k2,k4->k3,k5->k4
# R8 X$ f6 l, Y% k6->k6 k7->k7
: z& a. b; {' e1 a5 g+ Z% dGlcdt = k-1*C(Fru)-(k1+k2)*C(Glc);
' P) [6 K0 w# C( L* M) R2 i% dFrudt = k1*C(Glc)-(k-1+k3+k4)C(Fru);, K( Q6 a/ g7 J1 v' E5 Z9 {# B
% dFadt = k(2)*C(Glc)+k4*C(Fru)+(k6+k7)*C(Hmf);
5 U$ C# _3 J+ ?% dLadt = k(7)*C(Hmf);1 N5 X" }. c( ~7 ?! `
%dHmfdt = k(3)*C(Fru)-(k6+k7)*C(Hmf);
, M3 b7 J8 r/ C3 G) x5 p! i/ h, iclear all! C, h/ R8 r3 Y* E
clc* ~4 J f- k# P$ c0 S2 j
format long
; {. J' |: N0 d- K6 P% t/min Glc Fru Fa La HMF/ mol/L
( o% S1 P$ T e4 V+ t Kinetics=[0 0.25 0 0 0 0
* z7 c& u4 h* r3 l D 15 0.2319 0.01257 0.0048 0 2.50E-04' _+ I+ g% K' A c7 q
30 0.19345 0.027 0.00868 0 7.00E-04
5 [$ m$ ~5 V7 d 45 0.15105 0.06975 0.02473 0 0.00335 Z3 P. T4 }8 t+ F: m1 E; W4 n7 {( d
60 0.13763 0.07397 0.02615 0 0.00428
' m' v0 k+ E- s3 }7 c( v 90 0.08115 0.07877 0.07485 0 0.01405
9 W f `" p( c 120 0.0656 0.07397 0.07885 0.00573 0.02143
5 k' P2 x6 L8 c 180 0.04488 0.0682 0.07135 0.0091 0.03623, R0 R7 O* l6 i% O; R& V7 e+ j+ y- O
240 0.03653 0.06488 0.08945 0.01828 0.05452! A% R7 u7 K* s6 f) K2 @6 c
300 0.02738 0.05448 0.09098 0.0227 0.0597
' v9 C$ k4 d" | j. r$ ]. n 360 0.01855 0.04125 0.09363 0.0239 0.06495];- U9 m+ Q1 P/ n# i' m
k0 = [0.0000000005 0.0000000005 0.0000000005 0.00000000005 0.00005 0.0134 0.00564 0.00001 0.00001 0.00001]; % 参数初值
: m; j, [1 M [: h- Glb = [0 0 0 0 0 0 0 0 0 0]; % 参数下限% |+ `& J6 L. v: H* t9 o2 Q
ub = [1 1 1 1 1 1 1 1 1 1]; % 参数上限( n* O7 s. W2 R
x0 = [0.25 0 0 0 0];7 Z; v2 p( A I4 @/ {
yexp = Kinetics; % yexp: 实验数据[x1 x4 x5 x6], k' k* |& v8 W1 ^( Q# u5 Y
% warning off
M& C% Q+ G# f A3 }% 使用函数 ()进行参数估计' s% V# E- h5 d. t, ~
[k,fval,flag] = fmincon(@ObjFunc7Fmincon,k0,[],[],[],[],lb,ub,[],[],x0,yexp);
6 X8 _1 j) Q2 X! @fprintf('\n使用函数fmincon()估计得到的参数值为:\n')
0 x( L; p$ W) `, `fprintf('\tk1 = %.11f\n',k(1))* _/ @7 V! [+ q4 p1 s4 F* Z. N! x: S, x
fprintf('\tk2 = %.11f\n',k(2)). n/ f/ ^) L( p
fprintf('\tk3 = %.11f\n',k(3))
6 V8 m4 Q, U5 ^6 Dfprintf('\tk4 = %.11f\n',k(4))
4 Q# g: X" d, H9 s# C/ `fprintf('\tk5 = %.11f\n',k(5))
" A' A3 p( m6 f d! nfprintf('\tk6 = %.11f\n',k(6))
7 q0 p* Z# C5 gfprintf('\tk7 = %.11f\n',k(7))
% L& S; E* d- S/ y Yfprintf('\tk8 = %.11f\n',k(8))
1 p8 [! Y6 J: o6 lfprintf('\tk9 = %.11f\n',k(9))5 z1 l5 v5 b8 o; x' l1 C
fprintf('\tk10 = %.11f\n',k(10))
9 G$ B, V1 A5 I: g% ]! |fprintf(' The sum of the squares is: %.1e\n\n',fval)6 h4 _9 P% a: I2 T
k_fm= k;, j4 h+ T' R/ Z1 {" p
% warning off
+ e5 r) }5 y: A; H& x% 使用函数lsqnonlin()进行参数估计
, v. P9 N8 W7 J, X9 d3 m+ ~: E1 V- s3 x[k,resnorm,residual,exitflag,output,lambda,jacobian] = ...2 D4 b3 {2 T5 ~1 C; F$ X
lsqnonlin(@ObjFunc7LNL,k0,lb,ub,[],x0,yexp);
7 y, O% A, j& ^8 W+ @ci = nlparci(k,residual,jacobian);
; Q/ n3 A8 Z% w7 ]3 p, z/ ofprintf('\n\n使用函数lsqnonlin()估计得到的参数值为:\n')
8 B. n2 M: ?. Y' Y/ qfprintf('\tk1 = %.11f\n',k(1))- J/ V7 T) \: b" k- B R# g& v- ^
fprintf('\tk2 = %.11f\n',k(2))
9 |2 Z' v& _; ?3 T ^fprintf('\tk3 = %.11f\n',k(3))
+ ~" N/ g) l; o b; j/ xfprintf('\tk4 = %.11f\n',k(4))
* P% ^2 n$ l; G$ ^2 H% N- j5 G& w2 Dfprintf('\tk5 = %.11f\n',k(5)). n' o9 l6 _6 P( p; M! Z4 [$ t
fprintf('\tk6 = %.11f\n',k(6))
% U+ @) ]6 B/ d* qfprintf('\tk7 = %.11f\n',k(7))( k+ o; Q7 z5 L) B
fprintf('\tk8 = %.11f\n',k(8))& n$ k- l6 G% u! h0 L
fprintf('\tk9 = %.11f\n',k(9))9 O# T+ P; M2 k3 d; q) l
fprintf('\tk10 = %.11f\n',k(10))
& v) D# a/ P- _ N0 Z% o/ M' Vfprintf(' The sum of the squares is: %.1e\n\n',resnorm)& F W: @: P# G5 w
k_ls = k;. i3 t# @0 s& Y& \: @* z& [
output
' V* }1 j; A! {4 rwarning off/ g7 X( ?! X N; P) E+ w* Q' p+ k
% 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& s8 A, }+ G( s, Z8 P% Y! g
k0 = k_fm;* [: f6 v7 P' L1 }) U4 x
[k,resnorm,residual,exitflag,output,lambda,jacobian] = ...2 k$ N) {/ t6 \
lsqnonlin(@ObjFunc7LNL,k0,lb,ub,[],x0,yexp);
V2 f9 ?0 i* ~+ c- U" l! yci = nlparci(k,residual,jacobian);& m. q. Y+ {" e5 z) s! O" p
fprintf('\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')
/ ?0 y6 ^8 u( {0 L; Pfprintf('\tk1 = %.11f\n',k(1))) u o6 e" [1 P) O
fprintf('\tk2 = %.11f\n',k(2))( d* X: W9 H- k, p
fprintf('\tk3 = %.11f\n',k(3))
6 n% N6 n3 d& }# tfprintf('\tk4 = %.11f\n',k(4))
1 D1 z$ y& a; `1 t' tfprintf('\tk5 = %.11f\n',k(5))
- F& _3 v$ N" O+ Zfprintf('\tk6 = %.11f\n',k(6))
8 ~; h/ d0 y, k- w! qfprintf('\tk7 = %.11f\n',k(7))3 B4 j, P5 j8 X* e+ G
fprintf('\tk8 = %.11f\n',k(8)) w) F0 W* \+ R
fprintf('\tk9 = %.11f\n',k(9))2 V. n, _% }, H* ]# E5 B0 l
fprintf('\tk10 = %.11f\n',k(10))* P! g+ z1 E! u. n
fprintf(' The sum of the squares is: %.1e\n\n',resnorm)4 [. a# ^4 @( Z" C: Z+ ]
k_fmls = k;
: S- M! U- E! t# ~- }output
7 N! e& e5 s1 \7 w4 X: N4 Ktspan = [0 15 30 45 60 90 120 180 240 300 360];
7 M' G) z2 i- i' m- y$ p9 [[t x] = ode45(@KineticEqs,tspan,x0,[],k_fmls); * s5 a3 m6 I2 B+ w u4 B, J- B
figure;! f9 z y( S0 H8 U5 J3 N
plot(t,x(:,1),t,yexp(:,2),'*');legend('Glc-pr','Glc-real')
; N y: n. I7 {! @$ A+ {1 T$ @figure;plot(t,x(:,2:5));
* c6 D2 z( R( p6 O! U7 Mp=x(:,1:5)
! p, x! ^6 {. w+ }; J( ~hold on
& C: W* C$ U/ E0 F% U& X1 Wplot(t,yexp(:,3:6),'o');legend('Fru-pr','Fa-pr','La-pr','HMF-pr','Fru-real','Fa-real','La-real','HMF-real')
. S7 k; t) Y; n& \5 B2 Q; t" o' G/ k* a2 y6 `
2 Z! l# u: R! C" Y! U
) g3 v' U: [/ {) O8 Hfunction f = ObjFunc7LNL(k,x0,yexp)
" a' X1 P+ ?- B5 y. {9 M4 dtspan = [0 15 30 45 60 90 120 180 240 300 360];( `' y' ]7 q9 l) B
[t, x] = ode45(@KineticEqs,tspan,x0,[],k); 4 s, L$ o% L, |" l4 \
y(:,2) = x(:,1);) u. v& u. ] @' y l8 j
y(:,3:6) = x(:,2:5);. k' i. t0 e7 D. F8 h% L; i
f1 = y(:,2) - yexp(:,2);5 _! `" e5 _$ t: h, l; I1 ?6 b
f2 = y(:,3) - yexp(:,3);
; e! y7 w$ H T" \& |0 yf3 = y(:,4) - yexp(:,4);8 B5 b1 |& k8 B" m4 e, f
f4 = y(:,5) - yexp(:,5);
5 l$ T, ?( T3 V. x& d4 r: ^( Df5 = y(:,6) - yexp(:,6);2 c% _. u8 {& R. @! `
f = [f1; f2; f3; f4; f5];5 b: X K2 i( T3 o. R& A
0 [ k0 }* F" Q9 \! T& h2 T
9 n/ s; q2 V0 @/ L( D5 Z
4 x" m' L; A5 ^/ j2 pfunction f = ObjFunc7Fmincon(k,x0,yexp)
8 }7 p% L5 v% s+ ~tspan = [0 15 30 45 60 90 120 180 240 300 360];
( X& b, |3 M* `# x; w& s[t x] = ode45(@KineticEqs,tspan,x0,[],k);
) P: M4 ?5 d/ E8 Y' Jy(:,2) = x(:,1);
' k8 Q' \/ |5 E' R6 \! F$ ky(:,3:6) = x(:,2:5);, z' _- G) ]& I6 k) j
f = sum((y(:,2)-yexp(:,2)).^2) + sum((y(:,3)-yexp(:,3)).^2) ...
8 e. w$ g* p$ m6 z: A + sum((y(:,4)-yexp(:,4)).^2) + sum((y(:,5)-yexp(:,5)).^2) ...
' Y2 y$ U5 ?+ n + sum((y(:,6)-yexp(:,6)).^2) ;9 T' C- f: w+ o- q
: _' {0 A2 J! e
& d0 u' Q, o% H9 d# r7 l8 U ?0 y3 M# \# Z2 b3 Q: J* K! ^& t6 L) M
5 U0 ?6 ~8 A; ]* G5 Z. _function dxdt = KineticEqs(t,x,k)
% n7 J7 G0 v8 R( m/ c( W }" adGldt = k(1)*x(2)-(k(2)+k(3)+k(8))*x(1); B- `6 I( ]/ O1 x' S
dFrdt = k(2)*x(1)-(k(1)+k(4)+k(5)+k(9))*x(2); @7 e( v3 Q: h
dFadt = k(3)*x(1)+k(5)*x(2)+(k(6)+k(7))*x(5);
3 q+ U: Z6 @8 | mdLadt = k(7)*x(5);
* y0 F: Y* @& K9 q) N( gdHmdt = k(4)*x(2)-(k(6)+k(7)+k(10))*x(5);
$ l; R$ d7 L% P- e+ w5 Bdxdt = [dGldt; dFrdt; dFadt; dLadt; dHmdt];
) p- v% h0 Q: a& l# Q- s4 B% H) g# r$ [/ \) i3 G7 |1 q i
* r4 E5 | q |5 ]2 ^: ^ T" Y
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