Difference between revisions of "mrcImageMultiCTFCompensation"
(→-i data) |
(→Case: m=17) |
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Line 375: | Line 375: | ||
=== Option -W=== | === Option -W=== | ||
− | ====Case: W= | + | ====Case: W=1==== |
<div>-o 's image</div> | <div>-o 's image</div> | ||
<table> | <table> | ||
Line 386: | Line 386: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left">- | + | <td><p align="left">-17.0714 (27, 31, 0)<br> |
− | + | 23.2441 (40, 52, 0)<br> | |
− | + | 5.81327e-09<br> | |
− | + | 4.65713<br> | |
− | 0. | + | 0.0582141<br></p> |
</td> | </td> | ||
</tr> | </tr> | ||
Line 405: | Line 405: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left"> | + | <td><p align="left">3.22907e-07 (0, 0, 0)<br> |
− | + | 62.9461 (46, 78, 0)<br> | |
− | + | 1.28884<br> | |
− | + | 4.68843<br> | |
− | 0. | + | 0.0586053<br></p> |
</td> | </td> | ||
</tr> | </tr> | ||
</table> | </table> | ||
− | |||
=== Option -WR=== | === Option -WR=== | ||
Line 427: | Line 426: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left">- | + | <td><p align="left">-11.5567 (27, 31, 0)<br> |
− | + | 15.7516 (24, 39, 0)<br> | |
− | + | 1.23206e-08<br> | |
− | + | 3.24282<br> | |
− | 0. | + | 0.0405352<br></p> |
</td> | </td> | ||
</tr> | </tr> | ||
Line 446: | Line 445: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left"> | + | <td><p align="left">2.72506e-08 (75, 37, 0)<br> |
− | + | 45.7637 (46, 78, 0)<br> | |
− | + | 0.700623<br> | |
− | + | 3.33709<br> | |
− | 0. | + | 0.0417136<br></p> |
</td> | </td> | ||
</tr> | </tr> | ||
</table> | </table> | ||
− | |||
=== Option -SinWin=== | === Option -SinWin=== | ||
Line 468: | Line 466: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left">- | + | <td><p align="left">-39.9332 (48, 52, 0)<br> |
− | + | 102.315 (36, 38, 0)<br> | |
− | + | 1.52273e-07<br> | |
− | + | 18.7407<br> | |
− | + | 0.234259<br></p> | |
</td> | </td> | ||
</tr> | </tr> | ||
Line 487: | Line 485: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left">0 ( | + | <td><p align="left">0 (40, 1, 0)<br> |
− | + | 378.143 (42, 0, 0)<br> | |
− | + | 4.1815<br> | |
− | + | 19.8843<br> | |
− | + | 0.248553<br></p> | |
</td> | </td> | ||
</tr> | </tr> | ||
</table> | </table> | ||
− | |||
=== Option -ctfMode=== | === Option -ctfMode=== | ||
Line 509: | Line 506: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left">- | + | <td><p align="left">-24.2681 (68, 48, 0)<br> |
− | + | 207.103 (36, 38, 0)<br> | |
− | - | + | -1.0943e-09<br> |
− | + | 45.5848<br> | |
− | + | 0.56981<br></p> | |
− | </td> | + | </td> |
</tr> | </tr> | ||
</table> | </table> | ||
Line 529: | Line 526: | ||
</td> | </td> | ||
<td><p align="left">0 (0, 0, 0)<br> | <td><p align="left">0 (0, 0, 0)<br> | ||
− | + | 1280.12 (41, 0, 0)<br> | |
− | + | 6.47008<br> | |
− | + | 51.7633<br> | |
− | + | 0.647041<br></p> | |
</td> | </td> | ||
</tr> | </tr> | ||
</table> | </table> | ||
− | |||
====Case: ctfMode=256==== | ====Case: ctfMode=256==== | ||
Line 549: | Line 545: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left">- | + | <td><p align="left">-191.228 (36, 38, 0)<br> |
− | + | 26.7763 (67, 30, 0)<br> | |
− | - | + | -3.91243e-08<br> |
− | + | 45.3127<br> | |
− | + | 0.566409<br></p> | |
</td> | </td> | ||
</tr> | </tr> | ||
Line 569: | Line 565: | ||
</td> | </td> | ||
<td><p align="left">0 (0, 0, 0)<br> | <td><p align="left">0 (0, 0, 0)<br> | ||
− | + | 1280.12 (41, 0, 0)<br> | |
− | + | 5.38217<br> | |
− | + | 51.6411<br> | |
− | + | 0.645514<br></p> | |
− | </td> | + | </td> |
</tr> | </tr> | ||
</table> | </table> | ||
− | |||
====Case: ctfMode=257==== | ====Case: ctfMode=257==== | ||
Line 589: | Line 584: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left">- | + | <td><p align="left">-90.5402 (36, 37, 0)<br> |
− | + | 39.3153 (49, 51, 0)<br> | |
− | + | -1.30477e-07<br> | |
− | + | 18.1267<br> | |
− | + | 0.226584<br></p> | |
</td> | </td> | ||
</tr> | </tr> | ||
Line 608: | Line 603: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left"> | + | <td><p align="left">1.17451e-06 (75, 37, 0)<br> |
− | + | 378.143 (42, 0, 0)<br> | |
− | + | 3.33762<br> | |
− | + | 19.4523<br> | |
− | + | 0.243154<br></p> | |
</td> | </td> | ||
</tr> | </tr> | ||
</table> | </table> | ||
− | |||
=== Option -m=== | === Option -m=== | ||
− | ====Case: m=1, W= | + | ====Case: m=1, W=1==== |
=====Case: No other settings===== | =====Case: No other settings===== | ||
<div>-o 's image</div> | <div>-o 's image</div> | ||
Line 631: | Line 625: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left">- | + | <td><p align="left">-9.82557 (48, 51, 0)<br> |
− | + | 92.1757 (49, 32, 0)<br> | |
− | + | 6.14297<br> | |
− | + | 14.8838<br> | |
− | 0. | + | 0.186048<br></p> |
− | </td> | + | </td> |
</tr> | </tr> | ||
</table> | </table> | ||
Line 650: | Line 644: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left">0. | + | <td><p align="left">0.00108315 (40, 41, 0)<br> |
− | + | 491.438 (0, 0, 0)<br> | |
− | + | 4.1562<br> | |
− | + | 18.0735<br> | |
− | 0. | + | 0.225919<br></p> |
</td> | </td> | ||
</tr> | </tr> | ||
Line 661: | Line 655: | ||
<div>-log 's data</div> | <div>-log 's data</div> | ||
<pre> | <pre> | ||
− | iter 0 : rms | + | iter 0 : rms 1.013455e+01 : min 1.000000e+06 |
+ | iter 1 : rms 1.355871e+00 : min 1.013455e+01 | ||
+ | iter 2 : rms 8.647722e-01 : min 1.355871e+00 | ||
+ | iter 3 : rms 6.229646e-01 : min 8.647722e-01 | ||
+ | iter 4 : rms 4.844930e-01 : min 6.229646e-01 | ||
+ | iter 5 : rms 3.971868e-01 : min 4.844930e-01 | ||
+ | iter 6 : rms 3.377429e-01 : min 3.971868e-01 | ||
+ | iter 7 : rms 2.951728e-01 : min 3.377429e-01 | ||
+ | iter 8 : rms 2.629044e-01 : min 2.951728e-01 | ||
+ | iter 9 : rms 2.370113e-01 : min 2.629044e-01 | ||
</pre> | </pre> | ||
− | ====Case: solventMode=1==== | + | =====Case: solventMode=1===== |
<div>-o 's image</div> | <div>-o 's image</div> | ||
<table> | <table> | ||
Line 675: | Line 678: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left">- | + | <td><p align="left">-20.1029 (48, 51, 0)<br> |
− | + | 87.1488 (49, 32, 0)<br> | |
− | + | 2.38926<br> | |
− | + | 14.7396<br> | |
− | 0. | + | 0.184245<br></p> |
</td> | </td> | ||
</tr> | </tr> | ||
Line 694: | Line 697: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left">0. | + | <td><p align="left">0.00627302 (76, 14, 0<br> |
− | + | 222.088 (42, 0, 0)<br> | |
− | + | 4.12707<br> | |
− | + | 15.7098<br> | |
− | 0. | + | 0.196372<br></p> |
</td> | </td> | ||
</tr> | </tr> | ||
Line 705: | Line 708: | ||
<div>-log 's data</div> | <div>-log 's data</div> | ||
<pre> | <pre> | ||
− | iter 0 : rms | + | iter 0 : rms 3.709238e+01 : min 1.000000e+06 |
+ | iter 1 : rms 3.539059e+00 : min 3.709238e+01 | ||
+ | iter 2 : rms 1.971014e+00 : min 3.539059e+00 | ||
+ | iter 3 : rms 1.314187e+00 : min 1.971014e+00 | ||
+ | iter 4 : rms 9.704149e-01 : min 1.314187e+00 | ||
+ | iter 5 : rms 7.649823e-01 : min 9.704149e-01 | ||
+ | iter 6 : rms 6.304888e-01 : min 7.649823e-01 | ||
+ | iter 7 : rms 5.362647e-01 : min 6.304888e-01 | ||
+ | iter 8 : rms 4.668152e-01 : min 5.362647e-01 | ||
+ | iter 9 : rms 4.135905e-01 : min 4.668152e-01 | ||
</pre> | </pre> | ||
− | + | =====Case: solventSTD=2.0, solventMode=1===== | |
− | ====Case: solventSTD=2.0, solventMode=1==== | + | |
<div>-o 's image</div> | <div>-o 's image</div> | ||
<table> | <table> | ||
Line 720: | Line 731: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left"> | + | <td><p align="left">85.3666 (27, 31, 0)<br> |
− | + | 146.065 (58, 33, 0)<br> | |
− | + | 101.654<br> | |
− | + | 5.9911<br> | |
− | 0. | + | 0.0748887<br></p> |
</td> | </td> | ||
</tr> | </tr> | ||
Line 739: | Line 750: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left">0. | + | <td><p align="left">0.00707058 (78, 44, 0)<br> |
− | + | 8132.32 (0, 0, 0)<br> | |
− | + | 4.62714<br> | |
− | + | 143.824<br> | |
− | + | 1.7978<br></p> | |
</td> | </td> | ||
</tr> | </tr> | ||
Line 750: | Line 761: | ||
<div>-log 's data</div> | <div>-log 's data</div> | ||
<pre> | <pre> | ||
− | iter 0 : rms | + | iter 0 : rms 1.424218e+00 : min 1.000000e+06 |
− | iter 1 : rms | + | iter 1 : rms 2.156973e-01 : min 1.424218e+00 |
− | iter 2 : rms | + | iter 2 : rms 1.394271e-01 : min 2.156973e-01 |
− | iter 3 : rms 1. | + | iter 3 : rms 1.043566e-01 : min 1.394271e-01 |
− | iter 4 : rms | + | iter 4 : rms 8.473523e-02 : min 1.043566e-01 |
− | iter 5 : rms | + | iter 5 : rms 7.243526e-02 : min 8.473523e-02 |
− | iter 6 : rms | + | iter 6 : rms 6.412249e-02 : min 7.243526e-02 |
− | iter 7 : rms | + | iter 7 : rms 5.819677e-02 : min 6.412249e-02 |
− | iter 8 : rms | + | iter 8 : rms 5.380184e-02 : min 5.819677e-02 |
− | iter 9 : rms | + | iter 9 : rms 5.044070e-02 : min 5.380184e-02 |
</pre> | </pre> | ||
− | + | =====Case: MaxIter=5, solventSTD=2.0, solventMode=1===== | |
− | ====Case: MaxIter=5, solventSTD=2.0, solventMode=1==== | + | |
<div>-o 's image</div> | <div>-o 's image</div> | ||
<table> | <table> | ||
Line 774: | Line 784: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left"> | + | <td><p align="left">35.7164 (27, 31, 0)<br> |
− | + | 94.8793 (58, 33, 0)<br> | |
− | + | 52.0534<br> | |
− | + | 5.94982<br> | |
− | 0. | + | 0.0743728<br></p> |
</td> | </td> | ||
</tr> | </tr> | ||
Line 793: | Line 803: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left">0. | + | <td><p align="left">0.00307367 (71, 39, 0)<br> |
− | + | 4164.28 (0, 0, 0)<br> | |
− | + | 3.33262<br> | |
− | + | 73.8045<br> | |
− | + | 0.922556<br></p> | |
</td> | </td> | ||
</tr> | </tr> | ||
Line 804: | Line 814: | ||
<div>-log 's data</div> | <div>-log 's data</div> | ||
<pre> | <pre> | ||
− | iter 0 : rms | + | iter 0 : rms 1.424218e+00 : min 1.000000e+06 |
− | iter 1 : rms | + | iter 1 : rms 2.156973e-01 : min 1.424218e+00 |
− | iter 2 : rms | + | iter 2 : rms 1.394271e-01 : min 2.156973e-01 |
− | iter 3 : rms 1. | + | iter 3 : rms 1.043566e-01 : min 1.394271e-01 |
− | iter 4 : rms | + | iter 4 : rms 8.473523e-02 : min 1.043566e-01 |
</pre> | </pre> | ||
− | |||
====Case: m=16==== | ====Case: m=16==== | ||
Line 823: | Line 832: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left">- | + | <td><p align="left">-90.5402 (36, 37, 0)<br> |
− | + | 39.3153 (49, 51, 0)<br> | |
− | + | -1.13944e-07<br> | |
− | + | 18.1267<br> | |
− | + | 0.226584<br></p> | |
</td> | </td> | ||
</tr> | </tr> | ||
Line 842: | Line 851: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left"> | + | <td><p align="left">1.17451e-06 (75, 37, 0)<br> |
− | + | 378.143 (42, 0, 0)<br> | |
− | + | 3.33762<br> | |
− | + | 19.4523<br> | |
− | + | 0.243154<br></p> | |
</td> | </td> | ||
</tr> | </tr> | ||
</table> | </table> | ||
− | |||
====Case: m=17==== | ====Case: m=17==== | ||
Line 863: | Line 871: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left"> | + | <td><p align="left">-363.432 (24, 39, 0)<br> |
− | + | 64206.9 (50, 53, 0)<br> | |
− | + | 12232.5<br> | |
− | + | 12224.9<br> | |
− | + | 152.812<br></p> | |
</td> | </td> | ||
</tr> | </tr> | ||
Line 882: | Line 890: | ||
SE<br></p> | SE<br></p> | ||
</td> | </td> | ||
− | <td><p align="left">0. | + | <td><p align="left">0.000769818 (62, 30, 0)<br> |
− | + | 978599 (0, 0, 0)<br> | |
− | + | 2152.97<br> | |
− | + | 21751<br> | |
− | + | 271.888<br></p> | |
</td> | </td> | ||
</tr> | </tr> | ||
Line 893: | Line 901: | ||
<div>-log 's data</div> | <div>-log 's data</div> | ||
<pre> | <pre> | ||
− | iter 0 : rms | + | iter 0 : rms 2.228456e+00 : min 1.000000e+06 |
− | iter 1 : rms | + | iter 1 : rms 1.072463e+00 : min 2.228456e+00 |
− | iter 2 : rms | + | iter 2 : rms 8.595473e-01 : min 1.072463e+00 |
− | iter 3 : rms | + | iter 3 : rms 7.822678e-01 : min 8.595473e-01 |
− | iter 4 : rms | + | iter 4 : rms 7.485957e-01 : min 7.822678e-01 |
− | iter 5 : rms | + | iter 5 : rms 7.339871e-01 : min 7.485957e-01 |
− | iter 6 : rms | + | iter 6 : rms 7.188863e-01 : min 7.339871e-01 |
− | iter 7 : rms | + | iter 7 : rms 7.127621e-01 : min 7.188863e-01 |
− | iter 8 : rms | + | iter 8 : rms 7.096454e-01 : min 7.127621e-01 |
− | iter 9 : rms | + | iter 9 : rms 7.069848e-01 : min 7.096454e-01 |
</pre> | </pre> |
Latest revision as of 08:10, 22 September 2014
mrcImageMultiCTFCompensation is Eos's Command that performs CTF Correction to multiple images that have each other same field and different CTF. It outputs the average image of each image after CTF Correction.
Contents
List of option
Main option
Option | Essential/Optional | Description | Default |
---|---|---|---|
-i | Essential | Input: ASCII(File List) | stdin |
-info2 | Optional | Input: ASCII(File List) | stdin |
-o | Essential | Output(average): mrcImage | stdout |
-f | Optional | Output(average): mrcImage(FFT) | stdout |
-W | Optional | WhiteNoise(Noise/Signal) | 1.0 |
-WR | Optional | WhiteNoiseRaising | 1.0 |
-SinWin | Optional | sin Windowing (R[/A]): (SinWinRmin, SinWinRmax) | (0.1, 1.0) |
-MaxIter | Optional | Max Iteration | 10 |
-ctfMode | Optional | CTFMode | 1 |
-solventMode | Optional | If solvent flatterning is used, NEED | 0 |
-solventSTD | Optional | If solvent flatterning is used as mode=1, NEED | -1.0 |
-Log | Optional | Log File Name | stderr |
-c | Optional | ConfigurationFile | NULL |
-m | Optional | Mode | 0 |
-h | Optional | Help |
-ctfMode details
Value | Description |
---|---|
0 | Phase Only |
1 | Phase and Amplitude |
+32 | With Illumination Angle |
+256 | As Absolute Value |
-m details
Value | Description |
---|---|
0 | CTF-weighted compensation, CTF/(SQR(CTF) + (NS)^2) |
+1 | Adding solvent-flattening process |
+16 | Without phase flipping, in case of images after phase only correction. |
-i format
filename0 deltaF[A] Cs[mm] kV[kV] ratioOfAmpToPhase filename1 deltaF[A] Cs[mm] kV[kV] ratioOfAmpToPhase . . . . . . . . . . . . . . .
-Info2 format
filename0.ctfinfo filename1.ctfinfo . . .
Execution example
-i data
![]() |
Min Max |
0 (0, 0, 0) 255 (49, 32, 0) |
Use simulation images that is multiplied each different CTF to above image, as input file.
/Eos/img/Input-B120-CTF2.mrc 27000 2.1 200 0.1 /Eos/img/Input-B120-CTF3.mrc 9000 2.1 200 0.1 /Eos/img/Input-B120-CTF4.mrc 27000 2.1 400 0.1 /Eos/img/Input-B120-CTF5.mrc 27000 2.1 200 0.3
![]() |
Min Max |
-67.2449 (35, 36, 0) 48.4524 (50, 51, 0) |
Min Max |
-49.3218 (28, 26, 0) 133.566 (37, 38, 0) |
![]() |
Min Max |
-57.5666 (25, 38, 0) 53.971 (44, 29, 0) |
Min Max |
-49.4192 (47, 51, 0) 137.108 (49, 32, 0) |
![]() |
Min Max |
-68.355 (24, 39, 0) 42.4746 (44, 26, 0) |
Min Max |
-43.0975 (26, 31, 0) 117.683 (49, 32, 0) |
![]() |
Min Max |
-44.9091 (37, 36, 0) 26.5736 (28, 28, 0) |
Min Max |
-33.0969 (49, 51, 0) 73.3827 (35, 37, 0) |
Case: Options only essential
![]() |
Min Max |
-40.2801 (48, 52, 0) 104.151 (36, 38, 0) |
![]() |
Min Max |
7.30857e-06 (75, 37, 0) 378.143 (42, 0, 0) |
Option -W
Case: W=1
![]() |
Min Max |
-17.0714 (27, 31, 0) 23.2441 (40, 52, 0) |
![]() |
Min Max |
3.22907e-07 (0, 0, 0) 62.9461 (46, 78, 0) |
Option -WR
Case: WR=10.0, W=0.5
![]() |
Min Max |
-11.5567 (27, 31, 0) 15.7516 (24, 39, 0) |
![]() |
Min Max |
2.72506e-08 (75, 37, 0) 45.7637 (46, 78, 0) |
Option -SinWin
Case: SinWin=(0.05, 0.2)
![]() |
Min Max |
-39.9332 (48, 52, 0) 102.315 (36, 38, 0) |
![]() |
Min Max |
0 (40, 1, 0) 378.143 (42, 0, 0) |
Option -ctfMode
Case: ctfMode=32
![]() |
Min Max |
-24.2681 (68, 48, 0) 207.103 (36, 38, 0) |
![]() |
Min Max |
0 (0, 0, 0) 1280.12 (41, 0, 0) |
Case: ctfMode=256
![]() |
Min Max |
-191.228 (36, 38, 0) 26.7763 (67, 30, 0) |
![]() |
Min Max |
0 (0, 0, 0) 1280.12 (41, 0, 0) |
Case: ctfMode=257
![]() |
Min Max |
-90.5402 (36, 37, 0) 39.3153 (49, 51, 0) |
![]() |
Min Max |
1.17451e-06 (75, 37, 0) 378.143 (42, 0, 0) |
Option -m
Case: m=1, W=1
Case: No other settings
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Min Max |
-9.82557 (48, 51, 0) 92.1757 (49, 32, 0) |
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Min Max |
0.00108315 (40, 41, 0) 491.438 (0, 0, 0) |
iter 0 : rms 1.013455e+01 : min 1.000000e+06 iter 1 : rms 1.355871e+00 : min 1.013455e+01 iter 2 : rms 8.647722e-01 : min 1.355871e+00 iter 3 : rms 6.229646e-01 : min 8.647722e-01 iter 4 : rms 4.844930e-01 : min 6.229646e-01 iter 5 : rms 3.971868e-01 : min 4.844930e-01 iter 6 : rms 3.377429e-01 : min 3.971868e-01 iter 7 : rms 2.951728e-01 : min 3.377429e-01 iter 8 : rms 2.629044e-01 : min 2.951728e-01 iter 9 : rms 2.370113e-01 : min 2.629044e-01
Case: solventMode=1
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Min Max |
-20.1029 (48, 51, 0) 87.1488 (49, 32, 0) |
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Min Max |
0.00627302 (76, 14, 0 222.088 (42, 0, 0) |
iter 0 : rms 3.709238e+01 : min 1.000000e+06 iter 1 : rms 3.539059e+00 : min 3.709238e+01 iter 2 : rms 1.971014e+00 : min 3.539059e+00 iter 3 : rms 1.314187e+00 : min 1.971014e+00 iter 4 : rms 9.704149e-01 : min 1.314187e+00 iter 5 : rms 7.649823e-01 : min 9.704149e-01 iter 6 : rms 6.304888e-01 : min 7.649823e-01 iter 7 : rms 5.362647e-01 : min 6.304888e-01 iter 8 : rms 4.668152e-01 : min 5.362647e-01 iter 9 : rms 4.135905e-01 : min 4.668152e-01
Case: solventSTD=2.0, solventMode=1
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Min Max |
85.3666 (27, 31, 0) 146.065 (58, 33, 0) |
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Min Max |
0.00707058 (78, 44, 0) 8132.32 (0, 0, 0) |
iter 0 : rms 1.424218e+00 : min 1.000000e+06 iter 1 : rms 2.156973e-01 : min 1.424218e+00 iter 2 : rms 1.394271e-01 : min 2.156973e-01 iter 3 : rms 1.043566e-01 : min 1.394271e-01 iter 4 : rms 8.473523e-02 : min 1.043566e-01 iter 5 : rms 7.243526e-02 : min 8.473523e-02 iter 6 : rms 6.412249e-02 : min 7.243526e-02 iter 7 : rms 5.819677e-02 : min 6.412249e-02 iter 8 : rms 5.380184e-02 : min 5.819677e-02 iter 9 : rms 5.044070e-02 : min 5.380184e-02
Case: MaxIter=5, solventSTD=2.0, solventMode=1
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Min Max |
35.7164 (27, 31, 0) 94.8793 (58, 33, 0) |
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Min Max |
0.00307367 (71, 39, 0) 4164.28 (0, 0, 0) |
iter 0 : rms 1.424218e+00 : min 1.000000e+06 iter 1 : rms 2.156973e-01 : min 1.424218e+00 iter 2 : rms 1.394271e-01 : min 2.156973e-01 iter 3 : rms 1.043566e-01 : min 1.394271e-01 iter 4 : rms 8.473523e-02 : min 1.043566e-01
Case: m=16
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Min Max |
-90.5402 (36, 37, 0) 39.3153 (49, 51, 0) |
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Min Max |
1.17451e-06 (75, 37, 0) 378.143 (42, 0, 0) |
Case: m=17
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Min Max |
-363.432 (24, 39, 0) 64206.9 (50, 53, 0) |
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Min Max |
0.000769818 (62, 30, 0) 978599 (0, 0, 0) |
iter 0 : rms 2.228456e+00 : min 1.000000e+06 iter 1 : rms 1.072463e+00 : min 2.228456e+00 iter 2 : rms 8.595473e-01 : min 1.072463e+00 iter 3 : rms 7.822678e-01 : min 8.595473e-01 iter 4 : rms 7.485957e-01 : min 7.822678e-01 iter 5 : rms 7.339871e-01 : min 7.485957e-01 iter 6 : rms 7.188863e-01 : min 7.339871e-01 iter 7 : rms 7.127621e-01 : min 7.188863e-01 iter 8 : rms 7.096454e-01 : min 7.127621e-01 iter 9 : rms 7.069848e-01 : min 7.096454e-01