PERSAMAAN MULTIPLE NON-LINEAR REGRESSION

NO.

Variabel Independent

1
2
3
4
5
6
7

LOG P
E-HOMO
E-LUMO
LOG P, E-HOMO
E-HOMO, E-LUMO
LOG P, E-LUMO
LOG P, E-HOMO, E-LUMO

Intercept
3.9238
149.859
4.2715
297.240
-472.1893
4.4539
-263.7496

X2 Log P
0.0485
_

X LOG P
-0.1421
_

0.02299
_
-0.0636
-0.0435

-0.00106
_
0.75638
0.5649

Nilai Koefisien
X2 E-Homo
X E-Homo
_
_
1.5123
29.818
3.3039
-6.325
_
-3.632

62.3576
-109.919
_
-62.5137

X2 E-Lumo
_
_
-3.70959
_
4.225
-12.5124
-5.0377

X E-Lumo
_
_
1.5057
_
-3.603
1.03219
-2.304

0.6285
< 0,06303
0.8416
< 0,00114
0.7345
< 0,01406
0.9555
< 0,00009
0.8654
< 0,00869
0.93939307 < 0,00033
0.99379488 < 0,0000003

PERSAMAAN MULTIPLE LINEAR REGRESSION

NO.

Variabel Independent

1
2
3
4
5
6
7

LOG P
E-HOMO
E-LUMO
LOG P, E-HOMO
E-HOMO, E-LUMO
LOG P, E-LUMO
LOG P, E-HOMO, E-LUMO

Intercept
3.506
22.562
3.686
19.780
28.592
3.446
36.047

Nilai Koefisien
Log P
E-Homo
0.1896
_
_
0.121
_
0.111
0.1869

E-Lumo

_
2.054
_
1.786
2.705
_
3.559

_
_
1.282
_
-0.562
0.978
-1.657

0.5856
0.8335
0.6779
0.9074
0.8446
0.7424
0.9735

< 0,0277
< 0,000212
< 0,00771
< 0,00007
< 0,00104
< 0,01219
<0,0000001

PERSAMAAN MULTIPLE LINEAR REGRESSION

NO.
1
2
3
4
5
6
7

Variabel Independent

Persamaan Garis

LOG P
E-HOMO
E-LUMO
LOG P, E-HOMO
E-HOMO, E-LUMO
LOG P, E-LUMO
LOG P, E-HOMO, E-LUMO

Y = 0,1896 Log P + 3,506

Y = 2,054 E-Homo + 22,562
Y = 1,282 E-Lumo + 3,686
Y = 0,121 Log P + 1,786 E-Homo + 19,780
Y = 2,705 E-Homo -0,562 E-Lumo + 28,592
Y = 0,111 Log P + 0,978 E-Lumo + 3,446
Y = 0,1869 Log P + 3,559 E-Homo - 1,657 E-Lumo +36,047

PREDICTED VS OBESERVED MULTIPLE LINEAR REGRESSION

NO.

Observed
Value

Predicted
Value

Residual

1
2
3
4
5
6
7
8
9
10
11
12
13
14
Minimum
Maximum
Mean
Median

3.270000
3.850000
3.860000
4.040000
4.330000
4.470000
4.490000
4.620000
4.750000
4.090000
4.590000
4.480000
3.080000
3.110000
3.080000
4.750000
4.073571
4.210000

3.229504
3.983999
3.989343
4.140370
4.258079
4.336573
4.531020
4.629583
4.728879
4.157850
4.695543
4.120281
3.146066
3.082911
3.082911
4.728879
4.073571
4.149110

0.040496
-0.133999
-0.129343
-0.100370
0.071921
0.133427
-0.041020
-0.009583
0.021121
-0.067850
-0.105543
0.359719
-0.066066
0.027089
-0.133999
0.359719
0.000000
-0.025301

PREDICTED VS OBESERVED MULTIPLE NON-LINEAR REGRESSION

No.

Observed
Value

Predicted
Value

Residual

1
2
3
4
5
6
7
8
9
10
11
12
13
14
Minimum
Maximum
Mean
Median

3.270000
3.850000
3.860000
4.040000
4.330000
4.470000
4.490000
4.620000
4.750000
4.090000
4.590000
4.480000
3.080000
3.110000
3.080000
4.750000
4.073571
4.210000

3.282921
3.826159
3.935719
4.125024
4.306237
4.402758
4.593096
4.665312
4.679190
3.992394
4.613102
4.418350
3.112644
3.077094
3.077094
4.679190
4.073571
4.215631

-0.012921
0.023841
-0.075719
-0.085024
0.023763
0.067242
-0.103097
-0.045312
0.070810
0.097606
-0.023102
0.061650
-0.032644
0.032906
-0.103097
0.097606
0.000000
0.005421

PERSAMAAN MULTIPLE NON-LINEAR REGRESSION

NO.

Variabel Independent

Persamaan Garis

LOG P

Log 1/C = 0,0485Log P2 -0,1421 Log P + 3,9238

E-HOMO

Log 1/C= 1,5123 E Homo2 + 29,818 E Homo + 149,859

E-LUMO

Log 1/C= - 3,70959 E Lumo2 + 1,5057 E Lumo + 4,2715

LOG P, E-HOMO

Log 1/C= 0,02299Log P2 -0,00106 Log P + 3,3039 E Homo2 + 62,3576 E Homo + 297,24

E-HOMO, E-LUMO

Log 1/C= - 6,325 E Homo2 -109,919 E Homo + 4,225 E Lumo2 - 3,603 E Lumo - 472,1893

LOG P, E-LUMO

Log 1/C= - 0,0636 Log P2 + 0,75638 Log P - 12,5124 E Lumo2 + 1,03219 E Lumo + 4,4539

LOG P, E-HOMO, E-LUMO

Log 1/C= - 0.0435 Log P2 + 0.5649 Log P - 3.632 E Homo2 -62.5137 E Homo - 5.0377 E Lumo2 - 2.304 E Lumo - 263.7496