STEP 1
# Set variable
FILE=/tmp/mainfile
SEARCHFILE =/tmp/searchfile
# THIS IS THE MAIN FILE.
cat /tmp/mainfile
Interface Ethernet0/0 "outside", is up, line protocol is up
Hardware is i82546GB rev03, BW 100 Mbps
Full-Duplex(Full-duplex), 100 Mbps(100 Mbps)
MAC address... (6 Replies)
I am using the while-loop to read a file.
The file has lines with null-terminated strings (words, actually.)
What I have by that reading - just a first word up to '\0'!
I need to have whole string up to 'new line' - (LF, 10#10, 16#A)
What I am doing wrong?
#make file 'grb' with... (6 Replies)
Flow of program:
C based CGI is used
CGI1:
-Gets called when user hits upload button(submit) ie form action = CGI1
-Does the file upload (copy to a directory etc)
JS, Ajax fucntion:
-A JS function is called when user hits upload button
-The JS function opens an Ajax request for CGI2... (8 Replies)
Hi ,
I am trying to write an shell, which reads a text file (from a location) having a list of numbers of strictly 5 digits only ex: 33144
Now my script will check :
1) that each entry is only 5 digits & numeric only, no alphabets, & its not empty.
2)then it executes a shell script called... (8 Replies)
Hello, I am quite new in shell scripting and I would like to write a little scritp to run a program on some parameters files.
all my parameters files are in the same directory, so pick them up with
ls *.para >>dirafter that I have a dir file like that:
param1.para
param2.para
etc...
I... (2 Replies)
Hi All,
I'm trying to figure out which are the trusted-ips and which are not using a script file.. I have a file named 'ip-list.txt' which contains some ip addresses and another file named 'trusted-ip-list.txt' which also contains some ip addresses. I want to read a line from... (4 Replies)
Hello,
I need a program that read a file line by line and prints out lines 1, 2 & 3 after an empty line... An example of entries in the file would be:
SRVXPAPI001 ERRO JUN24 07:28:34 1775
REASON= 0000, PROCID= #E506 #1065: TPCIPPR, INDEX= 003F
... (8 Replies)
Hi All,
Am trying to write wrapper shell/bash script on a utility tool for which i need to pass 2 files as arugment to execute utility tool.
Wraper script am trying is to do with above metion 2 files.
utility tool accepts :
a. userinfo file : which contains username
b. item file : which... (2 Replies)
Hi all,
I have a log file say Test.log that gets updated continuously and it has data in pipe separated format. A sample log file would look like:
<date1>|<data1>|<url1>|<result1>
<date2>|<data2>|<url2>|<result2>
<date3>|<data3>|<url3>|<result3>
<date4>|<data4>|<url4>|<result4>
What I... (3 Replies)
Heyas
I'm trying to read/display a file its content and put borders around it (tui-cat / tui-cat -t(ypwriter).
The typewriter-part is a 'bonus' but still has its own flaws, but thats for later.
So in some way, i'm trying to rewrite cat using bash and other commands.
But sadly it fails on... (2 Replies)
Discussion started by: sea
2 Replies
LEARN ABOUT OPENDARWIN
geom
geom(1)geom(1)NAME
geom - analyzes a molecular geometry input in Cartesian coordinates.
DESCRIPTION
The program geom reads a set of Cartesian coordinates and determines from them the bond distances (Bohr and angstrom), bond angles, tor-
sional angles, out-of-plane angles (optional), moments of inertia, and rotational constants.
FILES REQUIRED
input.dat - Input file
and one of the following:
geom.dat - geometry file
file11.dat - PSI-format geometry/gradient file
FILES GENERATED
geom.out - file containing the analysis
INPUT OPTIONS
The geom program has the following options:
-h Print help information (these options).
-aces [filename]
Read the input in an ACES output format, with each line consisting of atomic symbol, atomic number, and Cartesian coordinates (in
Bohr). The optional argument is the name of the geometry input file, which defaults to geom.dat.
-qchem [filename]
Read the input in an QCHEM output format, with each line consisting of the atom number, the atomic symbol, and Cartesian coordinates
(in Angstroms). The optional argument is the name of the geometry input file, which defaults to geom.dat.
-xyz [filename]
Read the input in an XYZ output format. The first line contains the number of atoms and the second line is a comment line. Subse-
quent lines each contain the atomic symbol and Cartesian X Y and Z coordinates (in Angstroms). The optional argument is the name of
the geometry input file, which defaults to geom.dat.
-oop Print out-of-plane angles, where the angle a-b-c-d is defined as the angle formed by the vector a-d and the plane defined by atoms
b, c, and d.
DO_OOP = boolean
Same as command-line switch -oop described above.
ISOTOPES = matrix of reals/strings
Used to specify masses to be used in the calculation of the center of mass and rotational constants. One array is provided for each
isotopomer to be calculated. The arrays can mix floating point numbers with strings which designate isotopes. If this array is not
given and file11.dat is present, then the masses will be obtained by converting the atomic numbers in file11. If masses are not
given by ISOTOPES or by file11, then no mass-related quantities will be calculated.
-g [filename]
Read Cartesian coordinates from a file other than file11.dat. If a filename is not given, the default is geom.dat. The alternative
file is assumed to be in a format similar to that of PSI's geom.dat. Since such files do not contain atomic numbers, the moments of
inertia and rotational constants are not calculated if this option is used.
READ_GEOM = boolean
This option in input.dat tells geom to read the geometry from geom.dat in the PSI geom.dat format.
-a Print parameters for all pair distances.
PRINT_ALL_DIST = boolean
Same as -a flag described above.
-d distance
Only print parameters involving pairs of atoms which are less than distance bohr apart (default value is 4.0 bohr).
PRINT_DISTANCE = value
Same as -d flag described above.
-angstrom
The input coordinates are in angstroms, not bohr.
ANGSTROM = boolean
If TRUE, the input coordinates are in angstroms instead of bohr. The default is FALSE.
The following example is for calculating the geometrical information for water with several different isotopes. The geometry is
read from geom.dat rather than from file11.dat.
geom: (
read_geom = true
isotopes = (
(O H H)
(O D D)
(O18 1.007825 1.007825)
) )
5 June, 1998 geom(1)