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File: [CCP4] / ccp4 / doc / bplot.doc
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Revision: 1.6, Mon Dec 17 17:42:22 2007 UTC (2 years, 8 months ago) by ccb Branch: MAIN CVS Tags: series-6_1-root, series-6_1, series-6_0_99e-root, series-6_0_99e, series-6_0_99d-root, series-6_0_99d, release-6_1_3, release-6_1_24, release-6_1_2, release-6_1_13, release-6_1_1, release-6_1_0, pre_xia2_remove, pre-merge-release-6_1_3, pre-merge-6_0_99e, pre-merge-6_0_99d, pre-merge-20_4_2009, pre-merge-13_08_2009, post_merge-13_08_2009, post-merge-release-6_1_3, post-merge-6_0_99d, post-merge-20_4_2009, merge-release_6_1_0, merge-5_8_2008, branch-merge-20_4_2009, branch-merge-13_08_2009, HEAD Changes since 1.5: +15 -17 lines update for test release 6.0.991 |
BPLOT (CCP4: Supported Program)
NAME
bplot - Plot temperature factor by residue
SYNOPSIS
bplot XYZIN1 foo_in1.pdb XYZIN2 foo_in2.pdb plot foo.plt
[Keyworded input]
DESCRIPTION
This program is used to plot the temperature factors for residues in
the PDB input file using plot84 subroutine library. Average B-factors
for main chain atoms are plotted against residue number as a line
graph. Average B-factors for side chain atoms are plotted against
residue number as a histogram, unless the CROSSES keyword is specified.
The current version calculates the maximum B-value for the chain and
adjusts the y-axis scale accordingly.
The output meta-file PLOT can then be viewed with XPLOT84DRIVER, or
converted to PostScript, Tektronix or HPGL with PLTDEV.
KEYWORDED INPUT
The available keywords are:
BMAX, CBMAIN, CBSIDE, COMPARE, CROSSES, MAIN, PLTY, RES1, RES2 ,
SIDE, TITLE, XSCALE, YSCALE
TITLE <title>
Title to appear on the plot
PLTY
Plot with the x-axis along the length of the paper (landscape).
By default the picture is drawn with the x-axis along the width of the
paper (portrait).
CROSSES
Points for side chains marked with crosses.
By default the points are plotted as a histogram.
COMPARE
Tells the program there are two files to read.
For this option can only plot either main chains or side chains
MAIN
Plot the B values for the main chain only
(this card or SIDE is compulsory if two files input)
SIDE
Plot the B values for the side chains only
(this card or MAIN is compulsory if two files input)
XSCALE <xscale>
Set the scale along the x-axis explicitly
Default = 0.85
YSCALE <yscale>
Set the scale along the y-axis explicitly
Default = 0.85
BMAX <bmax>
The maximum y-axis value on the plot.
If the value you supplied is smaller then the calculated maximum B
value for this chain, the supplied <bmax> will not be used.
By default the program scales the plot according to the maximum B value
found in the input pdb file.
RES1 <res_beg> <res_end>
followed by the chain labels and numbers of the first and last residues
to be plotted from xyzin1
eg. RES1 A1 A224
RES2 <res_beg> <res_end>
followed by the chain labels and numbers of the first and last residues
to be plotted from xyzin2
eg. RES2 A1 A224
CBMAIN
Treat CB's as main chain atoms.
CBSIDE
Treat CB's as side chain atoms (default).
INPUT AND OUTPUT FILES
XYZIN1 Input coordinates
XYZIN2 Input second coordinate file (optional)
PLOT Plot meta-file for PLTDEV
AUTHORS
Originator : Miri Hirshberg
EXAMPLES
Unix example script found in $CEXAM/unix/runnable/
* bplot.exam
SEE ALSO
baverage
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