llExtract

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llExtract is Eos's Command that extracts llData from FFT data. llDataPrint can display output file as graph.

List of option

Main option

Option Essential/Optional Description Default
-t Optional Tiltle: ASCII[80] NULL
-s Optional Step[A]: (xStep, yStep) (1.0, 1.0)
-M Optional Max[GridUnit]: (MaxX, MaxY) (1.0, 1.0)
-i Optional Input: mrcImage(FFT) NULL
-1 Optional Output: NearSide: [llData] NULL
-2 Optional Output: FarSide: [llData] NULL
-R Optional RotationAngle: [Degree] 0.0
-O Optional Omega: [Degree] 0.0
-S Optional Shear: [Degree] 0.0
-I Optional ievery 0
-axl Optional axl 0.0
-ayl Optional ayl 0.0
-x Optional xShift: [GridUnit] 0.0
-l Optional llMax 0
-d Optional delRInv: [A] 0.0
-f Optional flagOutputInfo
-L Optional Variable: LayerLineInfo: (n, l, Y, leftMin, leftMax, rightMin, rightMax, weight) ... (0, 0, 0.0, 0.0, 0.0, 0.0, 0.0, 1.0)
-c Optional ConfigurationFile: ASCII NULL
-m Optional Mode 0
-h Optional Help  
-s: must set (Lengthx, Lengthy).
-d: must set Nx * Lengthx


-m details

Value Description
0


ConfigurationFile format

Title
xStep  yStep
MaxX  MaxY
InputFileName
OutputFileName(NearSide)
OutputFileName(FarSide)
RotationAngle
Omega
Share
ievery
axl
ayl
xShift
llMax
delRInv
flagOutputInfo
n0  l0  Y0  leftMin0  leftMax0  rightMin0  rightMax0  weight0
n1  l1  Y1  leftMin1  leftMax1  rightMin1  rightMax1  weight1
.
.

llExtractCtrlFileCreate can create it.
The data that is set by option is not read, but these lines must not be omitted.


Execution example

Input file image

by mrcFFTExpression(m=1)

1ATOMFil-FFT.png
Whole area

1ATOMFil-FFT1.png
Around center

Size

Mode
Length
Min
Max
Mean
SD

SE

( 512, 1146, 1)

mrcComplexFloatFT
( 2.000, 2.000, 0.000)
4.08519e-10 (257, 572, 0)
0.109661 (0, 0, 0)
0.00909953
0.00776913

1.01425e-05


Option -c

ConfigurationFile1

Setting the following data.
llData
2 2
255 572
In
Nea
Far
0.0
0.0
0.0
0
0.0
0.0
256
12
1024
0
     0      0      0 0 255 0 255 0.5
     2      2     72 0 255 0 255 1.0
     4      4    144 0 255 0 255 1.0
    -3     11    -66 0 255 0 255 1.0
    -1     13      6 0 255 0 255 1.0
     1     15     78 0 255 0 255 1.0
     3     17    150 0 255 0 255 1.0
    -4     24    -60 0 255 0 255 1.0
    -2     26     12 0 255 0 255 1.0
     0     28     84 0 255 0 255 1.0
     2     30    156 0 255 0 255 1.0
     4     32    228 0 255 0 255 1.0


-1 's data
LAYERLINE   0 NEAR................................................................................ 5.00000e-01    0    0
 0.00000e+00 1.09661e-01 1.00179e-05
 9.76562e-04 1.07064e-01 1.66569e-07
 1.95312e-03 9.94539e-02 1.79314e-06
 2.92969e-03 8.73620e-02 1.63306e-06
 3.90625e-03 7.16275e-02 9.95900e-07

...

 2.48047e-01 2.45430e-02 1.00179e-05
 2.49023e-01 2.57134e-02 1.00179e-05
 0.00000e+00 0.00000e+00 0.00000e+00
LAYERLINE   1 NEAR................................................................................ 1.00000e+00    2    2
 0.00000e+00 2.36747e-04 3.27016e+02
 9.76562e-04 2.19473e-05 3.21478e+02
 1.95312e-03 9.17815e-05 1.00204e+02
 2.92969e-03 2.42726e-04 4.08337e+01
 3.90625e-03 7.48780e-04 1.25217e+01

...

 2.48047e-01 5.52613e-03 7.64794e+01
 2.49023e-01 6.03607e-03 8.58422e+01
 0.00000e+00 0.00000e+00 0.00000e+00
LAYERLINE   2 NEAR................................................................................ 1.00000e+00    4    4
 0.00000e+00 1.56065e-03 2.94032e+02
 9.76562e-04 1.02912e-03 2.90051e+02
 1.95312e-03 7.23528e-04 2.77422e+02
 2.92969e-03 6.94803e-04 2.59534e+02
 3.90625e-03 8.97704e-04 2.50892e+02

...

LAYERLINE   3 NEAR................................................................................ 1.00000e+00   -3   11

...

LAYERLINE  11 NEAR................................................................................ 1.00000e+00    4   32

...

 2.45117e-01 2.10039e-02 3.42847e+02
 2.46094e-01 2.36644e-02 3.43764e+02
 2.47070e-01 2.59560e-02 3.44583e+02
 2.48047e-01 2.78412e-02 3.45314e+02
 2.49023e-01 2.92789e-02 3.45958e+02
 0.00000e+00 0.00000e+00 0.00000e+00


-2 's data
LAYERLINE   0 FAR ................................................................................ 5.00000e-01    0    0
 0.00000e+00 1.09661e-01 1.00179e-05
 9.76562e-04 1.07064e-01 1.00179e-05
 1.95312e-03 9.94539e-02 1.00179e-05
 2.92969e-03 8.73620e-02 1.00179e-05
 3.90625e-03 7.16275e-02 1.00179e-05

...

 2.48047e-01 2.45430e-02 5.44967e-07
 2.49023e-01 2.57134e-02 8.66931e-07
 0.00000e+00 0.00000e+00 0.00000e+00
LAYERLINE   1 FAR ................................................................................ 1.00000e+00    2    2
 0.00000e+00 2.36747e-04 3.27016e+02
 9.76562e-04 5.38817e-04 3.33733e+02
 1.95312e-03 9.34154e-04 3.39000e+02
 2.92969e-03 1.47219e-03 3.43420e+02
 3.90625e-03 2.23950e-03 3.46949e+02

...

 2.48047e-01 6.32650e-03 7.40293e+01
 2.49023e-01 6.41878e-03 8.40146e+01
 0.00000e+00 0.00000e+00 0.00000e+00
LAYERLINE   2 FAR ................................................................................ 1.00000e+00    4    4
 0.00000e+00 1.56065e-03 2.94032e+02
 9.76562e-04 2.26294e-03 2.94056e+02
 1.95312e-03 3.08391e-03 2.92763e+02
 2.92969e-03 3.96259e-03 2.91127e+02
 3.90625e-03 4.82953e-03 2.89482e+02

...

LAYERLINE   3 FAR ................................................................................ 1.00000e+00   -3   11

...

LAYERLINE  11 FAR ................................................................................ 1.00000e+00    4   32

...

 2.45117e-01 2.58909e-02 3.47760e+02
 2.46094e-01 2.80857e-02 3.47725e+02
 2.47070e-01 2.95940e-02 3.47578e+02
 2.48047e-01 3.04287e-02 3.47325e+02
 2.49023e-01 3.06231e-02 3.46968e+02
 0.00000e+00 0.00000e+00 0.00000e+00