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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
% q7 l# n, f0 z- |9 b2 R% k1->k-1,k2->k1,k3->k2,k4->k3,k5->k4$ t# q4 v! h, I5 t7 I' W( m
% k6->k6 k7->k7
; F7 y$ I, B' ~, B! A% dGlcdt = k-1*C(Fru)-(k1+k2)*C(Glc);' N8 x/ ~0 a4 K) H/ [
% dFrudt = k1*C(Glc)-(k-1+k3+k4)C(Fru);
8 G y0 ]) h& ]$ g% dFadt = k(2)*C(Glc)+k4*C(Fru)+(k6+k7)*C(Hmf);! S; Y7 n e. l
% dLadt = k(7)*C(Hmf);& V8 |8 A) J$ x0 Y- p$ a3 D0 e
%dHmfdt = k(3)*C(Fru)-(k6+k7)*C(Hmf);6 x* Q* X8 F9 w- `+ ]
clear all
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format long
4 g% T! L# S9 ^9 h. R2 _! F% t/min Glc Fru Fa La HMF/ mol/L
X8 F6 y/ _( k* L/ k2 J: { Kinetics=[0 0.25 0 0 0 0
1 H, @6 I. M" Y+ n' q 15 0.2319 0.01257 0.0048 0 2.50E-04
# O0 W2 @+ ~# u 30 0.19345 0.027 0.00868 0 7.00E-041 ^' H3 z- c P: e
45 0.15105 0.06975 0.02473 0 0.00334 Q" M6 P2 l) j& \; L# d3 ^- L( u
60 0.13763 0.07397 0.02615 0 0.004286 z+ R$ r. v ~% @1 K: q/ x
90 0.08115 0.07877 0.07485 0 0.01405- U( k+ w; O2 g# Z! k, m7 ^
120 0.0656 0.07397 0.07885 0.00573 0.02143
, A& K" e( ^) t/ L d8 @ 180 0.04488 0.0682 0.07135 0.0091 0.03623
: h' @* z! q! `0 [. [ 240 0.03653 0.06488 0.08945 0.01828 0.054521 U: ?2 c3 F1 N: g& l% Q
300 0.02738 0.05448 0.09098 0.0227 0.05972 v: w: L) K( p l! s- x
360 0.01855 0.04125 0.09363 0.0239 0.06495];1 @' E1 Y3 s7 M# V/ {
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5 ~7 ~6 y9 o0 q! _2 t- \/ y
lb = [0 0 0 0 0 0 0 0 0 0]; % 参数下限9 k( {2 F' R/ P' y* K8 W3 s5 S
ub = [1 1 1 1 1 1 1 1 1 1]; % 参数上限/ a: i( n) Z+ G" _ h# ~7 U
x0 = [0.25 0 0 0 0];
/ M+ j) C( _8 g" q7 Nyexp = Kinetics; % yexp: 实验数据[x1 x4 x5 x6]
* B: s8 R7 P6 t! W- I' C( K& V8 ]% warning off( Y3 K4 I2 I' X( D) B
% 使用函数 ()进行参数估计1 o0 Z2 K* ?9 K# E; o8 W* F
[k,fval,flag] = fmincon(@ObjFunc7Fmincon,k0,[],[],[],[],lb,ub,[],[],x0,yexp);- C2 C9 r. R' {& D; o5 k
fprintf('\n使用函数fmincon()估计得到的参数值为:\n')' K7 t0 P7 v4 _7 v8 \+ x& u# d
fprintf('\tk1 = %.11f\n',k(1)). P! |) E( c2 ?$ i. E# F3 }
fprintf('\tk2 = %.11f\n',k(2))& z% m+ ^3 N; p. o2 B' ]6 H
fprintf('\tk3 = %.11f\n',k(3))
h, K+ L6 G- [5 v& e* ufprintf('\tk4 = %.11f\n',k(4))! s* b* R4 ]0 R% m
fprintf('\tk5 = %.11f\n',k(5))
' c" k& ^; y: v* q; T. u. p$ e& wfprintf('\tk6 = %.11f\n',k(6))
6 E `! v {$ C5 i% M& t# Wfprintf('\tk7 = %.11f\n',k(7))0 {5 C0 D% I, I! A+ O/ G
fprintf('\tk8 = %.11f\n',k(8))
b+ Q. P; {% Bfprintf('\tk9 = %.11f\n',k(9))
- T6 ^- H" ^1 d- K1 j' h/ t, v* I Afprintf('\tk10 = %.11f\n',k(10))0 u. n+ I( p. d t2 F/ s
fprintf(' The sum of the squares is: %.1e\n\n',fval)
, m# ?+ M, f( h7 g# l/ h1 [k_fm= k;
3 ~$ _4 I6 P. L3 n7 W6 }5 H/ l( `0 ]% warning off' v5 ^% S9 c! D& _
% 使用函数lsqnonlin()进行参数估计1 X+ Q0 Q7 G r4 R: r
[k,resnorm,residual,exitflag,output,lambda,jacobian] = ...: v2 E6 C: o8 M
lsqnonlin(@ObjFunc7LNL,k0,lb,ub,[],x0,yexp);
0 u O/ ^7 [/ \ci = nlparci(k,residual,jacobian);* h5 }" \6 V9 f) ?0 H/ m# n
fprintf('\n\n使用函数lsqnonlin()估计得到的参数值为:\n')$ Z: i) u' s' m2 ~. j6 o! V
fprintf('\tk1 = %.11f\n',k(1))
/ M% b- {$ `! X9 s, Nfprintf('\tk2 = %.11f\n',k(2))
; {. ~+ d# O/ c6 B- zfprintf('\tk3 = %.11f\n',k(3))3 D7 j( @$ x" R% I, l
fprintf('\tk4 = %.11f\n',k(4))
$ x! D) b- j* ]1 a% a2 |, ^" y- Dfprintf('\tk5 = %.11f\n',k(5))
5 w9 ?; Y; E1 v3 W7 H5 l7 Zfprintf('\tk6 = %.11f\n',k(6))
O& t% a+ m* C* ]# ^5 Qfprintf('\tk7 = %.11f\n',k(7))' a5 o) o1 ^" \
fprintf('\tk8 = %.11f\n',k(8))1 W5 O) l% @0 |4 O
fprintf('\tk9 = %.11f\n',k(9))" [! U8 l& g; i" n$ \
fprintf('\tk10 = %.11f\n',k(10))
+ j" A `$ n% O1 y$ ?' H- c$ h0 cfprintf(' The sum of the squares is: %.1e\n\n',resnorm)7 y! t9 ^ a8 G+ O2 c+ m* |
k_ls = k;
) R' C {/ e/ v6 P$ y" U# D1 doutput
( b% f7 F' w; I5 X% ]8 Z3 pwarning off
/ |! e4 q# \6 ~ @7 `2 m- T: Y) b6 B% 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, R4 r0 V0 ^- ^. {
k0 = k_fm;
- X; K: o& N7 w# ^/ v8 j- n[k,resnorm,residual,exitflag,output,lambda,jacobian] = ...
6 R" |; e% _& T! J3 e' v9 m lsqnonlin(@ObjFunc7LNL,k0,lb,ub,[],x0,yexp);
8 d# |7 t6 t7 {/ j6 H- n( K2 {% A( O) gci = nlparci(k,residual,jacobian);
- e' h! [: W- E; Qfprintf('\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 \1 o2 t$ g+ p
fprintf('\tk1 = %.11f\n',k(1))
3 r& P1 j1 p/ G; l2 r! Rfprintf('\tk2 = %.11f\n',k(2))3 X' h0 b* t1 |" L# Y/ N
fprintf('\tk3 = %.11f\n',k(3))* I0 O' L X) r x" S' Q( c
fprintf('\tk4 = %.11f\n',k(4))
4 B2 L' |- R. p+ M9 L- l# kfprintf('\tk5 = %.11f\n',k(5)). a5 F) G, C! ^* g
fprintf('\tk6 = %.11f\n',k(6))
- |) e/ b! Y; i( s( G% nfprintf('\tk7 = %.11f\n',k(7)); J4 [2 j# c1 B8 C' X6 I' t
fprintf('\tk8 = %.11f\n',k(8))0 w, ^# U5 s! Q" c9 B- c* T
fprintf('\tk9 = %.11f\n',k(9))
2 E4 a$ w5 l) E: C& |; Efprintf('\tk10 = %.11f\n',k(10))6 z) B: i/ Y c% X
fprintf(' The sum of the squares is: %.1e\n\n',resnorm)* i5 f! c$ X( _
k_fmls = k;& P) C8 R6 } B, c9 d
output
( x* r4 y. l# W9 P4 Q5 }tspan = [0 15 30 45 60 90 120 180 240 300 360];: l$ V" H, `& T' Y5 P
[t x] = ode45(@KineticEqs,tspan,x0,[],k_fmls); 2 H% O% u0 A# i/ U) N$ R
figure;
# a9 o$ z$ A3 A5 A, B( K9 gplot(t,x(:,1),t,yexp(:,2),'*');legend('Glc-pr','Glc-real')( l* h& z* a* |0 D8 Q% E0 [! O
figure;plot(t,x(:,2:5));
# f3 o, w& B8 E" |0 _) f5 K1 Cp=x(:,1:5)
% T* o& G# l& k v* Z Fhold on
* R. G! U& C, Y! Z/ w& tplot(t,yexp(:,3:6),'o');legend('Fru-pr','Fa-pr','La-pr','HMF-pr','Fru-real','Fa-real','La-real','HMF-real')
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function f = ObjFunc7LNL(k,x0,yexp)( G8 \' u) [ A
tspan = [0 15 30 45 60 90 120 180 240 300 360];/ _) `4 ~ _# a
[t, x] = ode45(@KineticEqs,tspan,x0,[],k);
9 J. N5 p; v! Xy(:,2) = x(:,1);7 Q: F2 E+ A. ^7 h- F Z5 X
y(:,3:6) = x(:,2:5);/ u3 a& Z" d1 k8 X2 W
f1 = y(:,2) - yexp(:,2);
; u$ o" ^6 H6 ?5 C) Sf2 = y(:,3) - yexp(:,3);
$ Q6 x0 j5 P4 g1 jf3 = y(:,4) - yexp(:,4);
: u Q6 H' u$ H" R! W/ W! o2 @f4 = y(:,5) - yexp(:,5);- u# u2 [: O& }- e" c% v
f5 = y(:,6) - yexp(:,6);
# l' _: H' e! l" N' L' Lf = [f1; f2; f3; f4; f5];
@- M5 H- R6 y2 A2 I* n/ E2 A4 ^* ]
9 C) c! z' L9 T" S- I5 A- g3 g( |) N+ U) N$ J$ l
function f = ObjFunc7Fmincon(k,x0,yexp)
* x& r u# g$ R6 F- `3 ~9 j3 Itspan = [0 15 30 45 60 90 120 180 240 300 360];
( u4 ` O- ^7 U$ Q/ N, B[t x] = ode45(@KineticEqs,tspan,x0,[],k); ; C# p; n$ m0 }- c, T, H
y(:,2) = x(:,1);
3 u) X4 w) t' Ay(:,3:6) = x(:,2:5);
O3 Y% u+ X# t% I8 f" C( q/ Ff = sum((y(:,2)-yexp(:,2)).^2) + sum((y(:,3)-yexp(:,3)).^2) ...
( x8 Q$ |' x/ c; \1 D4 U8 ^ + sum((y(:,4)-yexp(:,4)).^2) + sum((y(:,5)-yexp(:,5)).^2) ...+ d) m5 j; c2 j! t3 f
+ sum((y(:,6)-yexp(:,6)).^2) ;
* M) D- H) m1 n8 [
1 h) _, f: U" a
! g5 n( \9 s+ M# R1 s' W. e1 H0 `% u
+ t" }1 n) s3 |function dxdt = KineticEqs(t,x,k)1 y3 W6 t8 T: _6 U. }3 Y2 _( G
dGldt = k(1)*x(2)-(k(2)+k(3)+k(8))*x(1);' ]1 S3 A. ^1 ~ e( p5 }' G) a
dFrdt = k(2)*x(1)-(k(1)+k(4)+k(5)+k(9))*x(2);
! V9 x; ^+ h# |2 Z3 p wdFadt = k(3)*x(1)+k(5)*x(2)+(k(6)+k(7))*x(5);. P$ [/ ?' b5 w1 | V9 C1 g5 l
dLadt = k(7)*x(5);) z! i( _" S$ A! g# q
dHmdt = k(4)*x(2)-(k(6)+k(7)+k(10))*x(5);
; O( Z5 H# _ @! K$ Edxdt = [dGldt; dFrdt; dFadt; dLadt; dHmdt];
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