icaoberg

Bootstrap: docker
From: alpine:edge

%labels
    AUTHOR icaoberg
    MAINTAINER icaoberg@psc.edu
    WEBSITE https://www.andrew.cmu.edu/~icaoberg
    VERSION 12.1.2

%post

icaoberg

Bootstrap: docker
From: alpine:edge

%labels
    AUTHOR icaoberg
    MAINTAINER icaoberg@psc.edu
    WEBSITE https://www.andrew.cmu.edu/~icaoberg
    VERSION 1.11.0

%post

icaoberg

#!/bin/bash

module keywords "Biological Sciences"

icaoberg

Bootstrap: docker
From: spack/ubuntu-bionic

%labels
    MAINTAINER icaoberg
    EMAIL icaoberg@psc.edu
    WEBSITE http://github.com/icaoberg/singularity-gromacs
    COPYRIGHT Copyright © 2021 Pittsburgh Supercomputing Center. All Rights Reserved. 
    VERSION 2021.1

icaoberg

set terminal pngcairo  transparent enhanced font "arial,10" fontscale 1.0 size 600, 400 
set output 'image.png'
set key outside right top vertical Right noreverse enhanced autotitle nobox
set title "plot with filledcurve [options]" 
set xrange [ * : * ] noreverse writeback
set x2range [ * : * ] noreverse writeback
set yrange [ * : * ] noreverse writeback
set y2range [ * : * ] noreverse writeback
set zrange [ * : * ] noreverse writeback
set cbrange [ * : * ] noreverse writeback

icaoberg

Bootstrap: docker
From: spack/ubuntu-bionic

%labels
    MAINTAINER icaoberg
    EMAIL icaoberg@psc.edu
    WEBSITE http://github.com/icaoberg/singularity-<PACKAGE-NAME>
    COPYRIGHT Copyright © 2021 Pittsburgh Supercomputing Center. All Rights Reserved. 
    VERSION <PACKAGE-VERSION>

icaoberg

#!/bin/bash

grep -v -xFf A.tsv B.tsv

icaoberg

#!/bin/bash

watch "scontrol show jobid $1 | grep StdOut | cut -d"=" -f2  | xargs tail -n 25"

icaoberg

#!/bin/bash

# @icaoberg 20/02/2020
# This script will
# * Download and extract a pre-release version of CellOrganizer v2.9.0
# * Run demo2D11. A training demo created for Sergiu Sanielevici
#
# For more information about CellOrganizer, visit the last release documentation
# http://www.cellorganizer.org/docs/2.8.1/
#

icaoberg

*.txt
*.bedg