pdbAtomSection

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pdbAtomSection is Eos's Command that cuts out section from Atoms Model, and outputs to ps file.


List of option

Main option

Option Essential/Optional Description Default
-i Essential Input: PDB NULL
-if Optional Input: ASCII(FlagsFile) NULL
-o Essential Output: psfile NULL
-dist Optional Distance of Sections 2.5
-zmin Optional z min 0.0
-zmax Optional z max 90.0
-fm Optional flag mode 13
-r Optional radius 1.0
-clw Optional Width of Circle 0.1
-plw Optional Width of Peptide bond 0.1
-fontsize Optional font size 2.0
-AS Optional absolute scale of PS file (-AS 1 := 1 mm/A) 1.0
-shiftx Optional pdb Shift x [A] 0.0
-shifty Optional pdb Shift y [A] 0.0
-shiftz Optional pdb Shift z [A] 0.0
-c Optional ConfigurationFile NULL
-m Optional Mode 0
-h Optional Help  

-m details

Value Description
0

-fm details

Value Description
0 display nothing
1 one char amino acid name
2 three char amino acid name
4 chain identifier
8 sequence number
16 display any atom

-if format

chainIdertifier&sequenceNumber(R123) FlagMode circleRedius circlelinewidth fontsize


Execution example

Input file image

Input-121P-PDB.png

Gravity Centre(CA)

Atom far from Centre(CA)

Atom far from Centre(CA, Axis)

6.053012e+00 2.519590e+01 1.189075e+01

3.286664e+01

24.77 23.85 28.04


Example of options only essential

Outdata-pdbAtomSection.png
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Option -AS

Case: AS=5

Outdata-AS-pdbAtomSection.png
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In the following, Setting at AS=5

Option -shiftx

Case: shiftx=10

Outdata-shiftx-pdbAtomSection.png
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In the following, Setting at shiftx=10

Option -shifty

Case: shifty=10

Outdata-shifty-pdbAtomSection.png
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Option -shiftz

Case: shiftz=1

Outdata-shiftz-pdbAtomSection.png
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Option -dist

Case: dist=3

Outdata-dist-pdbAtomSection.png
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Option -zmin

Case: zmin=1

Outdata-zmin-pdbAtomSection.png
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Option -zmax

Case: zmax=15

Outdata-zmax-pdbAtomSection.png
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Option -r

Case: r=0.5

Outdata-r-pdbAtomSection.png
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Option -plw

Case: plw=0.3

Outdata-plw-pdbAtomSection.png
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Option -fontsize

Case: fontsize=1

Outdata-fontsize-pdbAtomSection.png
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Option -fm

Case: fm=0

Outdata-fm0-pdbAtomSection.png
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Case: fm=1

Outdata-fm1-pdbAtomSection.png
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Case: fm=2

Outdata-fm2-pdbAtomSection.png
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Case: fm=4

Outdata-fm4-pdbAtomSection.png
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Case: fm=8

Outdata-fm8-pdbAtomSection.png
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Case: fm=16

Outdata-fm16-pdbAtomSection.png
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Option -if

-if 's data
A28 0 2.0 0.3 2
A147 1 0.5 0.3 4
A114 2 1.0 0.3 1
A128 4 1.0 0.3 4
A8 8 1.0 0.3 4
A56 16 0.5 0.3 4
A39 31 0.7 0.3 3


Output
Outdata-if-pdbAtomSection.png
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