This is the cronjob
----------------------
root@a7germ:/home/paxtemp > crontab -l|grep test
57 * * * * /home/paxtemp/test_1.sh
0,5,10,15,20,25,30,35,40,45,50,55 * * * * /home/paxtemp/test.sh
root@a7germ:/home/paxtemp >
This is the contents of test.sh script... (2 Replies)
Hey,
I have a file and it has only one field. I need to calculate the sum of each filed as total.
For e.g my file is
1
2
3
4
5
I need to calculate the total sum as 15.
Please let me know how i can do it? (4 Replies)
Hello all :)
I need some help; I'm running the sp_spaceused command on various tables and saving the output to a file. So, I have an input file that has 3 rows - each row has 7 columns. I would like to 1) sort the file on the 4th column, 2) take the 4th column in the first row and add 25% to... (2 Replies)
hi all,
have got a ksh script which tries to monitor memory usage of app servers. i do a ps -0 rss -p <PID> to get the memory size in KB but when i divide by 1024 to convert to MB i dont know how to round it up ??
thanks in advance. (3 Replies)
Hi
i data looks like this:
student 1
Subject1 45 55
Subject2 44 55
Subject3 33 44
//
student 2
Subject1 45 55
Subject2 44 55
Subject3 33 44
i would like to sum $2, $3 (marks) and divide each entry in $2 and $3 with their respective sums and print for each student as $4 and... (2 Replies)
I need to help to calculating using date in a script.
One application is licensed by date, some month at a time.
I can read the date from system and get an output like this:
echo $status
6A34 System4 01.01.11-31.01.11
My goal is to use license date 31.01.11 and subtract todays date... (7 Replies)
Hi All,
I have the following time stamp data in 2 columns
Date TimeStamp(also with milliseconds)
05/23/2012 08:30:11.250
05/23/2012 08:30:15.500
05/23/2012 08:31.15.500
.
.
etc
From this data I need the following output.
0.00( row1-row1 in seconds)
04.25( row2-row1 in... (5 Replies)
Hi.
I have a LOOONG list of samples but I am not sure how to write the loop/script to calculate the mean...
I normally use awk...
...................MEAN
Sample1 25.82 40.61333
Sample1 47.6
Sample1 48.42
Sample2 54.03 54.12
Sample2 53.98
Sample2 54.35
etc.....
I would like to... (4 Replies)
Hi
I have file like below
111,victor,48,12,36
342,Peter,54,58,30
476,Scott,25,36,48
567,Patty,74,17,95
I have written below code to calcualte avereage for every id
Victor = 48+12+36/3
#!/bin/ksh
/usr/xpg4/bin/awk '
BEGIN {FS=","} {sum=0; n=0;i=3 (1 Reply)
Discussion started by: stew
1 Replies
LEARN ABOUT DEBIAN
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)