fix

.gitignore

 *.img
 *.swp
-CentOS-7.5/
+*.simg
+CentOS-7.5
+CentOS/7.5-intel
+CentOS/7.5-VARROC
+CentOS/7.5-DHI
+CentOS/7.5-ESPRESO/CentOS-7.5-ESPRESO.simg.backup
 OpenFOAM/
 Ubuntu/16.04-OpenFOAM/

CentOS/6.9-GPU/CentOS-6.9-GPU-Bootstrap

-Bootstrap: docker
-From: centos:6.9
-IncludeCmd: yes
-
-%setup
-cp /apps/easybuild/sources/n/NVIDIA/NVIDIA-Linux-x86_64-390.30.run /tmp
-
-%post
-yum -y update && yum -y upgrade
-yum -y install python gcc make wget vim mc procps tcl gcc-c++ gcc-gfortran pkg-config acl acpid alsa-lib alsa-lib-devel amtu apr aspell at atk atk-devel attr audit audit-libs audit-libs-python authconfig autoconf autofs automake avahi-glib avahi-libs basesystem bash bc bind-libs bind-utils binutils binutils-devel bison bison-devel bluez-libs bridge-utils busybox bzip2 bzip2-devel bzip2-libs ca-certificates cairo cairo-devel c-ares ccid cdparanoia-libs centos-indexhtml centos-release checkpolicy chkconfig cloog-ppl compat-libcap1 compat-libstdc++-33 compat-readline5 ConsoleKit ConsoleKit-libs coolkey coreutils coreutils-libs cpio cpp cppunit cpupowerutils cpuspeed cracklib cracklib-dicts crash crda cronie cronie-anacron crontabs cryptsetup-luks cryptsetup-luks-libs cups cups-libs curl cvs cyrus-sasl cyrus-sasl-devel cyrus-sasl-gssapi cyrus-sasl-lib cyrus-sasl-plain dash db4 db4-cxx db4-devel db4-utils dbus dbus-devel dbus-glib dbus-glib-devel dbus-libs dbus-python dejavu-fonts-common dejavu-lgc-sans-mono-fonts dejavu-sans-mono-fonts desktop-file-utils device-mapper device-mapper-event device-mapper-event-libs device-mapper-libs device-mapper-multipath device-mapper-multipath-libs device-mapper-persistent-data diffutils dmidecode dmraid dmraid-events dmz-cursor-themes docbook-dtds docbook-style-dsssl docbook-style-xsl docbook-utils dos2unix dosfstools dracut dracut-kernel dracut-network dump e2fsprogs e2fsprogs-devel e2fsprogs-libs ed eggdbus eject elfutils-libelf elfutils-libelf-devel elfutils-libs emacs emacs-common environment-modules ethtool expat expat-devel expect file file-devel file-libs filesystem findutils finger fipscheck fipscheck-lib flac fontconfig fontconfig-devel fontpackages-filesystem foomatic foomatic-db foomatic-db-filesystem foomatic-db-ppds freeglut freeglut-devel freetype freetype-devel ftp fuse fuse-libs gamin gamin-python gawk gcc gcc-c++ gcc-gfortran GConf2 GConf2-devel gd gdb gdbm gdbm-devel gdk-pixbuf2 gdk-pixbuf2-devel genisoimage gettext gettext-devel gettext-libs ghostscript ghostscript-fonts giflib git glib2 glib2-devel glibc glibc-common glibc-debuginfo glibc-debuginfo-common glibc-devel glibc-headers glx-utils gmp gmp-devel gnome-icon-theme gnome-keyring gnome-keyring-devel gnome-themes gnome-vfs2 gnome-vfs2-devel gnupg2 gnuplot gnuplot-common gnutls gnutls-devel gperf gpgme gpm gpm-libs grep groff grub grubby gstreamer gstreamer-plugins-base gstreamer-tools gtk2 gtk2-devel gtk2-engines gtk-doc gzip hal hal-devel hal-info hal-libs hdparm hesiod hicolor-icon-theme hunspell hwdata hwloc hwloc-devel ilmbase ImageMagick indent info initscripts iproute iptables iptables-ipv6 iptstate iputils irqbalance iscsi-initiator-utils iso-codes iw jasper-libs jwhois kbd kbd-misc kernel kernel kernel-devel kernel-firmware kernel-headers keyutils keyutils-libs keyutils-libs-devel kpartx krb5-devel krb5-libs krb5-workstation ksh lcms-libs less lftp libacl libacl-devel libaio libart_lgpl libart_lgpl-devel libasyncns libattr libattr-devel libbasicobjects libblkid libbonobo libbonobo-devel libbonoboui libbonoboui-devel libcanberra libcanberra-gtk2 libcap libcap-devel libcap-ng libcgroup libcollection libcom_err libcom_err-devel libcroco libcroco-devel libcxgb3 libcxgb4 libdaemon libdhash libdrm libdrm-devel libedit libedit-devel libevent libexif libffi libfontenc libgcc libgcj libgcrypt libgcrypt-devel libgfortran libglade2 libglade2-devel libgnome libgnomecanvas libgnomecanvas-devel libgnome-devel libgomp libgpg-error libgpg-error-devel libgsf libgsf-devel libgssglue libgudev1 libhugetlbfs libibcm libibcm-devel libibverbs libibverbs-devel libibverbs-devel-static libibverbs-utils libICE libICE-devel libicu libIDL libIDL-devel libidn libidn-devel libini_config libipa_hbac libjpeg-turbo libjpeg-turbo-devel libldb libmcpp libmlx4 libmlx5 libmng libmng-devel libmthca libmthca-static libnetfilter_conntrack libnfnetlink libnih libnl libnl-devel libnotify libogg liboil libotf libpath_utils libpcap libpciaccess libpciaccess-devel libpng libpng-devel libproxy libproxy-bin libproxy-python libref_array librsvg2 librsvg2-devel libselinux libselinux-devel libselinux-python libselinux-utils libsemanage libsepol libsepol-devel libSM libSM-devel libsndfile libss libssh2 libsss_idmap libstdc++ libstdc++-devel libsysfs libsysfs-devel libtalloc libtasn1 libtasn1-devel libtdb libtevent libthai libtheora libtiff libtiff-devel libtirpc libtool-ltdl libudev libudev-devel libunistring libusb libusb1 libusb-devel libuser libutempter libuuid libvisual libvorbis libwmf libwmf-lite libwnck libX11 libX11-common libX11-devel libXau libXau-devel libXaw libXaw-devel libxcb libxcb-devel libXcomposite libXcomposite-devel libXcursor libXcursor-devel libXdamage libXdamage-devel libXdmcp libXdmcp-devel libXext libXext-devel libXfixes libXfixes-devel libXfont libXft libXft-devel libXi libXi-devel libXinerama libXinerama-devel libxkbfile libxml2 libxml2-devel libxml2-python libXmu libXmu-devel libXp libXpm libXpm-devel libXrandr libXrandr-devel libXrender libXrender-devel libXres libXScrnSaver libXScrnSaver-devel libxslt libxslt-devel libXt libXt-devel libXtst libXtst-devel libXv libXv-devel libXxf86misc libXxf86misc-devel libXxf86vm libXxf86vm-devel lm_sensors-libs lockdev logrotate lsof lvm2 lvm2-libs lynx lzo m17n-db m17n-db-datafiles m17n-lib m2crypto m4 mailcap mailx make MAKEDEV man man-pages mc mcpp mcstrans mdadm mesa-dri1-drivers mesa-dri-drivers mesa-dri-filesystem mesa-libGL mesa-libGL-devel mesa-libGLU mesa-libGLU-devel mesa-private-llvm mgetty microcode_ctl mingetty mkbootdisk mlocate module-init-tools mpfr mtools mtr mysql-libs nano nc ncurses ncurses-base ncurses-devel ncurses-libs net-snmp net-snmp-libs net-tools newt newt-python nfs-utils nfs-utils-lib nmap notification-daemon nscd nspr nspr-devel nss nss_db nss-devel nss-softokn nss-softokn-debuginfo nss-softokn-devel nss-softokn-freebl nss-softokn-freebl-devel nss-sysinit nss-tools nss-util nss-util-devel ntp ntpdate ntsysv OpenEXR-libs OpenIPMI OpenIPMI-libs openjade openjpeg-libs openldap openldap-devel openmotif openmotif22 opensp openssh openssh-clients openssh-server ORBit2 ORBit2-devel p11-kit p11-kit-trust pam pam-devel pam_krb5 pam_passwdqc pam_pkcs11 pango pango-devel paps paps-libs parted passwd patch pax pciutils pciutils-devel pciutils-libs pcmciautils pcp pcp-conf pcp-libs pcre pcsc-lite pcsc-lite-libs perf perl perl-AppConfig perl-Authen-SASL perl-Bit-Vector perl-Carp-Clan perl-CGI perl-Class-Singleton perl-Compress-Raw-Zlib perl-Compress-Zlib perl-Convert-ASN1 perl-Crypt-PasswdMD5 perl-Date-Calc perl-Date-Manip perl-DateTime perl-DBD-Pg perl-DBI perl-devel perl-Digest-HMAC perl-Digest-SHA1 perl-Error perl-ExtUtils-MakeMaker perl-ExtUtils-ParseXS perl-File-Which perl-Git perl-GSSAPI perl-HTML-Parser perl-HTML-Tagset perl-IO-Compress-Base perl-IO-Compress-Zlib perl-IO-Socket-SSL perl-JSON perl-LDAP perl-libs perl-libwww-perl perl-List-MoreUtils perl-Module-Pluggable perl-Net-LibIDN perl-Net-SSLeay perl-Net-Telnet perl-Params-Validate perl-PCP-PMDA perl-Pod-Escapes perl-Pod-Simple perl-SGMLSpm perl-Socket6 perl-String-CRC32 perl-TermReadKey perl-Test-Harness perl-Test-Simple perl-Text-Iconv perl-Time-HiRes perl-URI perl-version perl-WWW-Curl perl-XML-Filter-BufferText perl-XML-LibXML perl-XML-NamespaceSupport perl-XML-Parser perl-XML-SAX perl-XML-SAX-Writer perl-XML-Simple perl-YAML-Syck pinentry pinfo pixman pixman-devel pkgconfig plymouth plymouth-core-libs plymouth-scripts pm-utils policycoreutils polkit poppler poppler-data poppler-utils popt popt-devel portreserve postfix postgresql postgresql-devel postgresql-libs postgresql-odbc ppl ppp prelink procmail procps psacct psmisc pth pulseaudio-libs pycairo pycairo-devel pygobject2 pygobject2-codegen pygobject2-devel pygobject2-doc pygpgme pygtk2 pygtk2-codegen pygtk2-devel pygtk2-doc pyOpenSSL pytalloc python python-argparse python-devel python-iniparse python-libs python-pcp python-pycurl python-setuptools python-sssdconfig python-urlgrabber qt qt3 qt-sqlite qt-x11 quota rarian rarian-compat rdate rdma readahead readline readline-devel redhat-logos redhat-lsb redhat-lsb-compat redhat-lsb-core redhat-lsb-graphics redhat-lsb-printing redhat-menus redhat-rpm-config rmt rootfiles rpcbind rpm rpm-devel rpm-libs rpm-python rp-pppoe rrdtool rsh rsync ruby ruby-libs samba samba4-libs samba-common samba-winbind samba-winbind-clients screen SDL SDL-devel sed selinux-policy setserial setup setuptool sgml-common sgpio shadow-utils shared-mime-info slang smartmontools snappy sos sound-theme-freedesktop sqlite sqlite-devel sssd sssd-ad sssd-client sssd-common sssd-common-pac sssd-ipa sssd-krb5 sssd-krb5-common sssd-ldap sssd-proxy startup-notification startup-notification-devel strace stunnel sudo swig symlinks sysfsutils syslinux syslinux-nonlinux sysstat system-gnome-theme system-icon-theme systemtap-devel sysvinit-tools t1lib talk tar tcl tcl-devel tcpdump tcp_wrappers tcp_wrappers-libs tcsh telnet time tk tmpwatch traceroute tree tunctl tzdata udev udftools unix2dos unixODBC unixODBC-devel unzip upstart urw-fonts usbutils usermode ustr util-linux-ng vconfig vim-common vim-enhanced vim-filesystem vim-minimal virt-what wget which wireless-tools words wpa_supplicant xcb-util xdg-utils xerces-c xerces-c-devel xinetd xkeyboard-config xml-common xmlrpc-c xmlrpc-c-client xorg-x11-fonts-100dpi xorg-x11-fonts-75dpi xorg-x11-font-utils xorg-x11-proto-devel xorg-x11-server-common xorg-x11-server-utils xorg-x11-xauth xorg-x11-xkb-utils xterm xz xz-libs xz-lzma-compat ypbind yp-tools yum yum-metadata-parser yum-plugin-auto-update-debug-info yum-plugin-fastestmirror yum-plugin-priorities yum-plugin-security yum-plugin-versionlock yum-utils zip zlib zlib-devel
-
-yum -y groupinstall "Development Tools"
-
-cd /tmp
-
-# OpenMPI
-wget https://www.open-mpi.org/software/ompi/v2.1/downloads/openmpi-2.1.1.tar.gz
-tar xvf openmpi-2.1.1.tar.gz && cd openmpi-2.1.1
-./configure --prefix=/usr/local
-make -j 16
-make install
-
-# pip
-curl -s -O https://bootstrap.pypa.io/get-pip.py
-python get-pip.py
-
-pip install setuptools --upgrade
-
-# lua
-yum -y install lua lua-devel
-
-# lua posix and dependencies
-wget https://github.com/luarocks/luarocks/archive/v2.4.2.tar.gz
-tar xvf v2.4.2.tar.gz
-cd luarocks-2.4.2
-./configure
-make build
-make install
-mkdir ~/.luarocks
-echo "fs_use_modules = false" > ~/.luarocks/config.lua
-luarocks install luaposix
-luarocks install luafilesystem
-LUAROCKS_PREFIX=/usr/local
-export LUA_PATH="$LUAROCKS_PREFIX/share/lua/5.1/?.lua;$LUAROCKS_PREFIX/share/lua/5.1/?/init.lua;;"
-export LUA_CPATH="$LUAROCKS_PREFIX/lib/lua/5.1/?.so;;"
-
-# Lmod
-wget https://github.com/TACC/Lmod/archive/7.7.7.tar.gz
-tar xvf 7.7.7.tar.gz
-cd Lmod-7.7.7
-./configure --prefix=/opt/apps
-make install
-
-# GPU
-driver_version=390.30
-driver="/tmp/NVIDIA-Linux-x86_64-$driver_version.run"
-
-sh $driver -x
-mv NVIDIA-Linux-x86_64-$driver_version /usr/local/
-
-dir=/usr/local/NVIDIA-Linux-x86_64-$driver_version
-
-cd $dir
-ln -s libcuda.so.$driver_version libcuda.so
-ln -s libEGL.so.$driver_version libEGL.so
-ln -s libGLESv1_CM.so.$driver_version libGLESv1_CM.so
-ln -s libGLESv2.so.$driver_version libGLESv2.so
-ln -s libGL.so.$driver_version libGL.so
-ln -s libglx.so.$driver_version libglx.so
-ln -s libnvcuvid.so.$driver_version libnvcuvid.so
-ln -s libnvidia-cfg.so.$driver_version libnvidia-cfg.so
-ln -s libnvidia-compiler.so.$driver_version libnvidia-compiler.so
-ln -s libnvidia-eglcore.so.$driver_version libnvidia-eglcore.so
-ln -s libnvidia-encode.so.$driver_version libnvidia-encode.so
-ln -s libnvidia-fbc.so.$driver_version libnvidia-fbc.so
-ln -s libnvidia-glcore.so.$driver_version libnvidia-glcore.so
-ln -s libnvidia-glsi.so.$driver_version libnvidia-glsi.so
-ln -s libnvidia-gtk2.so.$driver_version libnvidia-gtk2.so
-ln -s libnvidia-gtk3.so.$driver_version libnvidia-gtk3.so
-ln -s libnvidia-ifr.so.$driver_version libnvidia-ifr.so
-ln -s libnvidia-ml.so.$driver_version libnvidia-ml.so
-ln -s libnvidia-ml.so.$driver_version libnvidia-ml.so.1
-ln -s libnvidia-opencl.so.$driver_version libnvidia-opencl.so
-ln -s libnvidia-tls.so.$driver_version libnvidia-tls.so
-ln -s libnvidia-wfb.so.$driver_version libnvidia-wfb.so
-ln -s libvdpau_nvidia.so.$driver_version libvdpau_nvidia.so
-ln -s libvdpau.so.$driver_version libvdpau.so
-ln -s libvdpau_trace.so.$driver_version libvdpau_trace.so
-ln -s libcuda.so.$driver_version libcuda.so.1
-
-# APPS and SCRATCH
-mkdir /apps
-mkdir /scratch
-
-%environment
-source /opt/apps/lmod/7.7.7/init/profile
-clearMT
-export -f ml
-export -f module
-export -f clearMT
-export LD_LIBRARY_PATH=/usr/local/cuda/lib64:/usr/local/cuda/extras/CUPTI/lib64:/usr/local/NVIDIA-Linux-x86_64-390.30:$LD_LIBRARY_PATH
-export PATH=/usr/local/NVIDIA-Linux-x86_64-390.30:/usr/local/cuda/bin:$PATH

CentOS/7.4-GPU/CentOS-7.4-GPU-Bootstrap

-Bootstrap: docker
-From: centos:latest
-
-%setup
-cp /apps/easybuild/sources/n/NVIDIA/NVIDIA-Linux-x86_64-390.30.run /tmp
-
-%post
-yum -y update && yum -y upgrade
-
-# CentOS repo
-yum -y install python gcc make wget vim mc procps tcl gcc-c++ gcc-gfortran pkg-config acl acpid alsa-lib alsa-lib-devel amtu apr aspell at atk atk-devel attr audit audit-libs audit-libs-python authconfig autoconf autofs automake avahi-glib avahi-libs basesystem bash bc bind-libs bind-utils binutils binutils-devel bison bison-devel bluez-libs bridge-utils busybox bzip2 bzip2-devel bzip2-libs ca-certificates cairo cairo-devel c-ares ccid cdparanoia-libs centos-indexhtml centos-release checkpolicy chkconfig cloog-ppl compat-libcap1 compat-libstdc++-33 compat-readline5 ConsoleKit ConsoleKit-libs coolkey coreutils coreutils-libs cpio cpp cppunit cpupowerutils cpuspeed cracklib cracklib-dicts crash crda cronie cronie-anacron crontabs cryptsetup-luks cryptsetup-luks-libs cups cups-libs curl cvs cyrus-sasl cyrus-sasl-devel cyrus-sasl-gssapi cyrus-sasl-lib cyrus-sasl-plain dash db4 db4-cxx db4-devel db4-utils dbus dbus-devel dbus-glib dbus-glib-devel dbus-libs dbus-python dejavu-fonts-common dejavu-lgc-sans-mono-fonts dejavu-sans-mono-fonts desktop-file-utils device-mapper device-mapper-event device-mapper-event-libs device-mapper-libs device-mapper-multipath device-mapper-multipath-libs device-mapper-persistent-data diffutils dmidecode dmraid dmraid-events dmz-cursor-themes docbook-dtds docbook-style-dsssl docbook-style-xsl docbook-utils dos2unix dosfstools dracut dracut-kernel dracut-network dump e2fsprogs e2fsprogs-devel e2fsprogs-libs ed eggdbus eject elfutils-libelf elfutils-libelf-devel elfutils-libs emacs emacs-common environment-modules ethtool expat expat-devel expect file file-devel file-libs filesystem findutils finger fipscheck fipscheck-lib flac fontconfig fontconfig-devel fontpackages-filesystem foomatic foomatic-db foomatic-db-filesystem foomatic-db-ppds freeglut freeglut-devel freetype freetype-devel ftp fuse fuse-libs gamin gamin-python gawk gcc gcc-c++ gcc-gfortran GConf2 GConf2-devel gd gdb gdbm gdbm-devel gdk-pixbuf2 gdk-pixbuf2-devel genisoimage gettext gettext-devel gettext-libs ghostscript ghostscript-fonts giflib git glib2 glib2-devel glibc glibc-common glibc-debuginfo glibc-debuginfo-common glibc-devel glibc-headers glx-utils gmp gmp-devel gnome-icon-theme gnome-keyring gnome-keyring-devel gnome-themes gnome-vfs2 gnome-vfs2-devel gnupg2 gnuplot gnuplot-common gnutls gnutls-devel gperf gpgme gpm gpm-libs grep groff grub grubby gstreamer gstreamer-plugins-base gstreamer-tools gtk2 gtk2-devel gtk2-engines gtk-doc gzip hal hal-devel hal-info hal-libs hdparm hesiod hicolor-icon-theme hunspell hwdata hwloc hwloc-devel ilmbase ImageMagick indent info initscripts iproute iptables iptables-ipv6 iptstate iputils irqbalance iscsi-initiator-utils iso-codes iw jasper-libs jwhois kbd kbd-misc kernel kernel kernel-devel kernel-firmware kernel-headers keyutils keyutils-libs keyutils-libs-devel kpartx krb5-devel krb5-libs krb5-workstation ksh lcms-libs less lftp libacl libacl-devel libaio libart_lgpl libart_lgpl-devel libasyncns libattr libattr-devel libbasicobjects libblkid libbonobo libbonobo-devel libbonoboui libbonoboui-devel libcanberra libcanberra-gtk2 libcap libcap-devel libcap-ng libcgroup libcollection libcom_err libcom_err-devel libcroco libcroco-devel libcxgb3 libcxgb4 libdaemon libdhash libdrm libdrm-devel libedit libedit-devel libevent libexif libffi libfontenc libgcc libgcj libgcrypt libgcrypt-devel libgfortran libglade2 libglade2-devel libgnome libgnomecanvas libgnomecanvas-devel libgnome-devel libgomp libgpg-error libgpg-error-devel libgsf libgsf-devel libgssglue libgudev1 libhugetlbfs libibcm libibcm-devel libibverbs libibverbs-devel libibverbs-devel-static libibverbs-utils libICE libICE-devel libicu libIDL libIDL-devel libidn libidn-devel libini_config libipa_hbac libjpeg-turbo libjpeg-turbo-devel libldb libmcpp libmlx4 libmlx5 libmng libmng-devel libmthca libmthca-static libnetfilter_conntrack libnfnetlink libnih libnl libnl-devel libnotify libogg liboil libotf libpath_utils libpcap libpciaccess libpciaccess-devel libpng libpng-devel libproxy libproxy-bin libproxy-python libref_array librsvg2 librsvg2-devel libselinux libselinux-devel libselinux-python libselinux-utils libsemanage libsepol libsepol-devel libSM libSM-devel libsndfile libss libssh2 libsss_idmap libstdc++ libstdc++-devel libsysfs libsysfs-devel libtalloc libtasn1 libtasn1-devel libtdb libtevent libthai libtheora libtiff libtiff-devel libtirpc libtool-ltdl libudev libudev-devel libunistring libusb libusb1 libusb-devel libuser libutempter libuuid libvisual libvorbis libwmf libwmf-lite libwnck libX11 libX11-common libX11-devel libXau libXau-devel libXaw libXaw-devel libxcb libxcb-devel libXcomposite libXcomposite-devel libXcursor libXcursor-devel libXdamage libXdamage-devel libXdmcp libXdmcp-devel libXext libXext-devel libXfixes libXfixes-devel libXfont libXft libXft-devel libXi libXi-devel libXinerama libXinerama-devel libxkbfile libxml2 libxml2-devel libxml2-python libXmu libXmu-devel libXp libXpm libXpm-devel libXrandr libXrandr-devel libXrender libXrender-devel libXres libXScrnSaver libXScrnSaver-devel libxslt libxslt-devel libXt libXt-devel libXtst libXtst-devel libXv libXv-devel libXxf86misc libXxf86misc-devel libXxf86vm libXxf86vm-devel lm_sensors-libs lockdev logrotate lsof lvm2 lvm2-libs lynx lzo m17n-db m17n-db-datafiles m17n-lib m2crypto m4 mailcap mailx make MAKEDEV man man-pages mc mcpp mcstrans mdadm mesa-dri1-drivers mesa-dri-drivers mesa-dri-filesystem mesa-libGL mesa-libGL-devel mesa-libGLU mesa-libGLU-devel mesa-private-llvm mgetty microcode_ctl mingetty mkbootdisk mlocate module-init-tools mpfr mtools mtr mysql-libs nano nc ncurses ncurses-base ncurses-devel ncurses-libs net-snmp net-snmp-libs net-tools newt newt-python nfs-utils nfs-utils-lib nmap notification-daemon nscd nspr nspr-devel nss nss_db nss-devel nss-softokn nss-softokn-debuginfo nss-softokn-devel nss-softokn-freebl nss-softokn-freebl-devel nss-sysinit nss-tools nss-util nss-util-devel ntp ntpdate ntsysv OpenEXR-libs OpenIPMI OpenIPMI-libs openjade openjpeg-libs openldap openldap-devel openmotif openmotif22 opensp openssh openssh-clients openssh-server ORBit2 ORBit2-devel p11-kit p11-kit-trust pam pam-devel pam_krb5 pam_passwdqc pam_pkcs11 pango pango-devel paps paps-libs parted passwd patch pax pciutils pciutils-devel pciutils-libs pcmciautils pcp pcp-conf pcp-libs pcre pcsc-lite pcsc-lite-libs perf perl perl-AppConfig perl-Authen-SASL perl-Bit-Vector perl-Carp-Clan perl-CGI perl-Class-Singleton perl-Compress-Raw-Zlib perl-Compress-Zlib perl-Convert-ASN1 perl-Crypt-PasswdMD5 perl-Date-Calc perl-Date-Manip perl-DateTime perl-DBD-Pg perl-DBI perl-devel perl-Digest-HMAC perl-Digest-SHA1 perl-Error perl-ExtUtils-MakeMaker perl-ExtUtils-ParseXS perl-File-Which perl-Git perl-GSSAPI perl-HTML-Parser perl-HTML-Tagset perl-IO-Compress-Base perl-IO-Compress-Zlib perl-IO-Socket-SSL perl-JSON perl-LDAP perl-libs perl-libwww-perl perl-List-MoreUtils perl-Module-Pluggable perl-Net-LibIDN perl-Net-SSLeay perl-Net-Telnet perl-Params-Validate perl-PCP-PMDA perl-Pod-Escapes perl-Pod-Simple perl-SGMLSpm perl-Socket6 perl-String-CRC32 perl-TermReadKey perl-Test-Harness perl-Test-Simple perl-Text-Iconv perl-Time-HiRes perl-URI perl-version perl-WWW-Curl perl-XML-Filter-BufferText perl-XML-LibXML perl-XML-NamespaceSupport perl-XML-Parser perl-XML-SAX perl-XML-SAX-Writer perl-XML-Simple perl-YAML-Syck pinentry pinfo pixman pixman-devel pkgconfig plymouth plymouth-core-libs plymouth-scripts pm-utils policycoreutils polkit poppler poppler-data poppler-utils popt popt-devel portreserve postfix postgresql postgresql-devel postgresql-libs postgresql-odbc ppl ppp prelink procmail procps psacct psmisc pth pulseaudio-libs pycairo pycairo-devel pygobject2 pygobject2-codegen pygobject2-devel pygobject2-doc pygpgme pygtk2 pygtk2-codegen pygtk2-devel pygtk2-doc pyOpenSSL pytalloc python python-argparse python-devel python-iniparse python-libs python-pcp python-pycurl python-setuptools python-sssdconfig python-urlgrabber qt qt3 qt-sqlite qt-x11 quota rarian rarian-compat rdate rdma readahead readline readline-devel redhat-logos redhat-lsb redhat-lsb-compat redhat-lsb-core redhat-lsb-graphics redhat-lsb-printing redhat-menus redhat-rpm-config rmt rootfiles rpcbind rpm rpm-devel rpm-libs rpm-python rp-pppoe rrdtool rsh rsync ruby ruby-libs samba samba4-libs samba-common samba-winbind samba-winbind-clients screen SDL SDL-devel sed selinux-policy setserial setup setuptool sgml-common sgpio shadow-utils shared-mime-info slang smartmontools snappy sos sound-theme-freedesktop sqlite sqlite-devel sssd sssd-ad sssd-client sssd-common sssd-common-pac sssd-ipa sssd-krb5 sssd-krb5-common sssd-ldap sssd-proxy startup-notification startup-notification-devel strace stunnel sudo swig symlinks sysfsutils syslinux syslinux-nonlinux sysstat system-gnome-theme system-icon-theme systemtap-devel sysvinit-tools t1lib talk tar tcl tcl-devel tcpdump tcp_wrappers tcp_wrappers-libs tcsh telnet time tk tmpwatch traceroute tree tunctl tzdata udev udftools unix2dos unixODBC unixODBC-devel unzip upstart urw-fonts usbutils usermode ustr util-linux-ng vconfig vim-common vim-enhanced vim-filesystem vim-minimal virt-what wget which wireless-tools words wpa_supplicant xcb-util xdg-utils xerces-c xerces-c-devel xinetd xkeyboard-config xml-common xmlrpc-c xmlrpc-c-client xorg-x11-fonts-100dpi xorg-x11-fonts-75dpi xorg-x11-font-utils xorg-x11-proto-devel xorg-x11-server-common xorg-x11-server-utils xorg-x11-xauth xorg-x11-xkb-utils xterm xz xz-libs xz-lzma-compat ypbind yp-tools yum yum-metadata-parser yum-plugin-auto-update-debug-info yum-plugin-fastestmirror yum-plugin-priorities yum-plugin-security yum-plugin-versionlock yum-utils zip zlib zlib-devel
-
-# Fedora repo
-yum -y install bash-completion pigz tmux
-
-yum -y groupinstall "Development Tools"
-
-cd /tmp
-
-# OpenMPI
-wget https://www.open-mpi.org/software/ompi/v2.1/downloads/openmpi-2.1.1.tar.gz
-tar xvf openmpi-2.1.1.tar.gz && cd openmpi-2.1.1
-./configure --prefix=/usr/local
-make -j 16
-make install
-
-# pip
-curl -s -O https://bootstrap.pypa.io/get-pip.py
-python get-pip.py
-
-pip install setuptools python-graph-core python-graph-dot tabulate numpy scipy pandas wheel --upgrade
-
-# lua
-wget http://dl.fedoraproject.org/pub/epel/7/x86_64/Packages/l/lua-posix-32-2.el7.x86_64.rpm
-wget http://dl.fedoraproject.org/pub/epel/7/x86_64/Packages/l/lua-filesystem-1.6.2-2.el7.x86_64.rpm
-wget http://mirror.centos.org/centos/7/os/x86_64/Packages/lua-devel-5.1.4-15.el7.x86_64.rpm
-wget http://dl.fedoraproject.org/pub/epel/7/x86_64/Packages/l/lua-bitop-1.0.2-3.el7.x86_64.rpm
-
-rpm -ihv lua-devel-5.1.4-15.el7.x86_64.rpm
-rpm -ihv lua-filesystem-1.6.2-2.el7.x86_64.rpm
-rpm -ihv lua-bitop-1.0.2-3.el7.x86_64.rpm
-rpm -ihv lua-posix-32-2.el7.x86_64.rpm
-
-# Lmod
-wget https://github.com/TACC/Lmod/archive/7.7.7.tar.gz
-tar xvf 7.7.7.tar.gz
-cd Lmod-7.7.7
-./configure --prefix=/opt/apps
-make install
-
-# GPU
-driver_version=390.30
-driver="/tmp/NVIDIA-Linux-x86_64-$driver_version.run"
-sh $driver -x
-mv NVIDIA-Linux-x86_64-$driver_version /usr/local/
-dir=/usr/local/NVIDIA-Linux-x86_64-$driver_version
-cd $dir
-ln -s libcuda.so.$driver_version libcuda.so
-ln -s libEGL.so.$driver_version libEGL.so
-ln -s libGLESv1_CM.so.$driver_version libGLESv1_CM.so
-ln -s libGLESv2.so.$driver_version libGLESv2.so
-ln -s libGL.so.$driver_version libGL.so
-ln -s libglx.so.$driver_version libglx.so
-ln -s libnvcuvid.so.$driver_version libnvcuvid.so
-ln -s libnvidia-cfg.so.$driver_version libnvidia-cfg.so
-ln -s libnvidia-compiler.so.$driver_version libnvidia-compiler.so
-ln -s libnvidia-eglcore.so.$driver_version libnvidia-eglcore.so
-ln -s libnvidia-encode.so.$driver_version libnvidia-encode.so
-ln -s libnvidia-fbc.so.$driver_version libnvidia-fbc.so
-ln -s libnvidia-glcore.so.$driver_version libnvidia-glcore.so
-ln -s libnvidia-glsi.so.$driver_version libnvidia-glsi.so
-ln -s libnvidia-gtk2.so.$driver_version libnvidia-gtk2.so
-ln -s libnvidia-gtk3.so.$driver_version libnvidia-gtk3.so
-ln -s libnvidia-ifr.so.$driver_version libnvidia-ifr.so
-ln -s libnvidia-ml.so.$driver_version libnvidia-ml.so
-ln -s libnvidia-ml.so.$driver_version libnvidia-ml.so.1
-ln -s libnvidia-opencl.so.$driver_version libnvidia-opencl.so
-ln -s libnvidia-tls.so.$driver_version libnvidia-tls.so
-ln -s libnvidia-wfb.so.$driver_version libnvidia-wfb.so
-ln -s libvdpau_nvidia.so.$driver_version libvdpau_nvidia.so
-ln -s libvdpau.so.$driver_version libvdpau.so
-ln -s libvdpau_trace.so.$driver_version libvdpau_trace.so
-ln -s libcuda.so.$driver_version libcuda.so.1
-
-# APPS and SCRATCH
-mkdir /apps
-mkdir /scratch
-
-%environment
-source /opt/apps/lmod/7.7.7/init/profile
-clearMT
-export -f ml
-export -f module
-export -f clearMT
-export LD_LIBRARY_PATH=/usr/local/cuda/lib64:/usr/local/cuda/extras/CUPTI/lib64:/usr/local/NVIDIA-Linux-x86_64-390.30:$LD_LIBRARY_PATH
-export PATH=/usr/local/NVIDIA-Linux-x86_64-390.30:/usr/local/cuda/bin:$PATH

CentOS/7.5-ESPRESO/app/log_crawler.py

+import sys
+import time
+import os
+import json
+import logging
+import shutil
+
+logging.basicConfig(level=logging.INFO)
+logger = logging.getLogger("Log crawler")
+
+PROGRESS_HEAD = '''<html>
+  <head>
+    <title>HPC job progress</title>
+    <script type="text/javascript">
+      function abort() {
+        notify_running_job("ABORT");
+      }
+    </script>
+  </head>'''
+
+PROGRESS_BODY='''<body style="margin: 20px; padding: 20px;">
+    <h1>HPC job progress</h1>
+    <div>
+    <h3>This is a waiter. It's waiting on the HPC cluster. It has waited {}/{} seconds.</h3>
+    <p>(Status from {}.)</p>
+    <p>Click the Abort button to stop the waiter early. Please click only once,
+    it will take a while until the request is processed. (The status might even
+    update once more before the job is aborted.)</p>
+    <input type="button" value="Abort" onclick="abort()">
+    </div>
+  </body>
+</html>
+'''
+
+PROGRESS_BODY_UNKNOWN='''<body style="margin: 20px; padding: 20px;">
+    <h1>HPC job progress</h1>
+    <div>
+    <h3>This is a waiter. It's waiting on the HPC cluster. Its status is unknown.</h3>
+    <input type="button" value="Abort job" onclick="abort()">
+    </div>
+  </body>
+</html>
+'''
+
+
+def main():
+    fn_log = sys.argv[1]
+    fn_status = sys.argv[2]
+
+    crawl_log(fn_log, fn_status)
+
+
+def crawl_log(fn_log, fn_status):
+    """Monitors a log file and creates html status pages from it
+
+    The log file is expected to grow only by one line at a time, with new lines
+    added to the end of the file. Each line is expected to be either a json
+    string containing the fields 'timestamp', 'elapsed_time', and 'total_time',
+    or the string 'FINISHED', which triggers the crawler to stop.
+
+    Note that this crawler is "memory-less", meaning that it cares only about
+    the last, newest line added to the log file while all prior lines are
+    disregarded.
+
+    Args:
+        fn_log (str): Filename of the log file to monitor
+        fn_status (str): Filename to write the status output to
+    """
+    logger.info("Log crawler starting up")
+    cached_stamp = 0
+    should_stop = False
+    while not should_stop:
+        if not os.path.exists(fn_log):
+            logger.info("Log file doesn't exist")
+        else:
+            # Check if "last modified" time of the log file has changed
+            stamp = os.stat(fn_log).st_mtime
+            if not stamp != cached_stamp:
+                logger.info("Log file hasn't changed since last check")
+            else:
+                logger.info("Log file has changed")
+                cached_stamp = stamp
+                
+                status = get_last_line(fn_log)
+                # We can stop crawling the logs if the main app is done
+                if status.strip() == "FINISHED":
+                    should_stop = True
+                    logger.info("Found FINISHED log, will stop now!")
+                # Otherwise, parse json and write status from it
+                else:
+                    try:
+                        log = json.loads(status)
+                        write_status(log, fn_status)
+                    except json.JSONDecodeError:
+                        write_status_unknown(fn_status)
+
+        time.sleep(1)
+    
+    logger.info("Log crawler terminating")
+
+
+def get_last_line(fn):
+    """Returns the last line of a file
+    
+    Args:
+        fn (str): File name of the file to read from
+    """
+    with open(fn, 'r') as fin:
+        for line in fin: 
+            pass
+        return line
+
+
+def write_status(log, fn_status):
+    """Writes a status html page using the information in 'log'
+
+    Args:
+        log (dict): Log containing the field 'timestamp', 'elapsed_time', and 
+            'total_time'
+        fn_status (str): Filename to write the status html to
+    """
+    status = PROGRESS_HEAD + PROGRESS_BODY.format(
+        log["elapsed_time"],
+        log["total_time"],
+        log["timestamp"],
+    )
+    # First write to a temporary file, then copy to actual status file. That
+    # way, the status file won't be corrupt if the writing process takes a 
+    # while.
+    fn_status_new = fn_status + '.new'
+    with open(fn_status_new, 'w') as fout:
+        fout.write(status)
+    shutil.copyfile(fn_status_new, fn_status)
+    
+    logger.info("Wrote status file")
+
+
+def write_status_unknown(fn_status):
+    """Writes a status html page when no actual status is known
+
+    Args:
+        fn_status (str): Filename to write the status html to
+    """
+    with open(fn_status, 'w') as fout:
+        fout.write(PROGRESS_HEAD + PROGRESS_BODY_UNKNOWN)
+    
+    logger.info("Wrote unknown status")
+
+
+if __name__ == "__main__":
+    main()
\ No newline at end of file

CentOS/7.5-ESPRESO/app/notifications_monitor.py

+import os
+import time
+import sys
+import logging
+
+logging.basicConfig(level=logging.INFO)
+logger = logging.getLogger("Notifications monitor")
+
+
+def main():
+    fn_notifications = sys.argv[1]
+    fn_abort = sys.argv[2]
+
+    monitor(fn_notifications, fn_abort)
+
+
+def monitor(fn_notifications, fn_abort):
+    """
+    """
+    logger.info("Notifications monitor starting up")
+    cached_stamp = 0
+    while True:
+        if not os.path.exists(fn_notifications):
+            logger.info("Notifications file doesn't exist")
+        else:
+            # Check if "last modified" time of the file has changed
+            stamp = os.stat(fn_notifications).st_mtime
+            if not stamp != cached_stamp:
+                logger.info("Notifications file hasn't changed since last check")
+            else:
+                logger.info("Notifications file has changed")
+                cached_stamp = stamp
+                
+                command = get_last_line(fn_notifications).strip()
+                
+                if command == "ABORT":
+                    logger.info("Received abort command")
+                    # Abort the main app by creating a specific file
+                    open(fn_abort, 'a').close()
+                else:
+                    logger.info("Ignoring unknown command {}".format(command))
+
+        time.sleep(1)
+
+
+def get_last_line(fn):
+    """Returns the last line of a file
+
+    Returns an empty string if the file is empty.
+    
+    Args:
+        fn (str): File name of the file to read from
+    """
+    with open(fn, 'r') as fin:
+        i = -1
+        for i, line in enumerate(fin): 
+            pass
+        if i >= 0:
+            return line
+        else:
+            return ''
+
+
+if __name__ == "__main__":
+    main()
\ No newline at end of file

CentOS/7.5-ESPRESO/app/startup.py

+import subprocess
+import sys
+import os
+import string
+import random
+import shutil
+import logging
+
+logging.basicConfig(level=logging.INFO)
+logger = logging.getLogger("Startup")
+
+
+def main():
+    # Input arguments
+    seconds_to_wait = int(sys.argv[1])
+    app_folder = sys.argv[2]
+
+    # Pre-defined files for communication with the "outside world"
+    fn_status = '/service/status.html'
+    fn_result = '/service/result.txt'
+    fn_notifications = '/service/notifications.txt'
+
+    # Write dummy value into result file
+    logger.info("Writing dummy result")
+    with open(fn_result, 'w') as fout:
+        fout.write("UNSET")
+
+    # Define files for the main app in a unique folder
+    ID = generate_id('/home')
+    unique_folder = os.path.join('/home', ID)
+    os.mkdir(unique_folder)
+    fn_log = os.path.join(unique_folder, 'main_log.txt')
+    fn_abort = os.path.join(unique_folder, 'main_abort.txt')
+    logger.info("Created unique folder {}".format(unique_folder))
+
+    # 1: Start log crawler as a background process
+    # The log crawler monitors a single log file and creates status html pages
+    # from it
+    # The log crawler will automatically terminate when it reads the finishing
+    # log from the main application
+    logger.info("Starting log crawler")
+    log_crawler_script = os.path.join(app_folder, 'log_crawler.py')
+    command = ['python', log_crawler_script, fn_log, fn_status]
+    proc_log = subprocess.Popen(command)
+
+    # 2: Start the notifications monitor as a background process
+    # It monitors the notifications file (which is written to when messages are
+    # sent to the HPC service running this Singularity image) and translates
+    # messages into comands to the main application. Here, this is done simply
+    # by creating a specific file the main app looks for. Only a single command
+    # (abort) is supported.
+    # The notifications monitor does _not_ terminate by itself.
+    logger.info("Starting notifications monitor")
+    not_monitor_script = os.path.join(app_folder, 'notifications_monitor.py')
+    command = ['python', not_monitor_script, fn_notifications, fn_abort]
+    proc_not = subprocess.Popen(command)
+
+    # 3: Start the main application as a foreground process
+    # The main application will write to the log file monitored by the crawler,
+    # and it will write its final result into the result file.
+    # It will also check periodically for the existence of 'fn_abort' and quit
+    # if this file exists. (This is a cheap way of sending a command to the
+    # main app.)
+    logger.info("Starting waiter")
+    waiter_script = os.path.join(app_folder, 'wait_a_while.py')
+    command = ['python', waiter_script, str(seconds_to_wait), fn_log,
+        fn_result, fn_abort]
+    subprocess.run(command)
+    logger.info("Waiter finished, terminating processes")
+
+    # 4: Terminate notifications monitor and remove log folders
+    # As the main app is finished at this point, we can safely terminate the
+    # notifications monitor
+    proc_log.terminate()
+    proc_not.terminate()
+    shutil.rmtree(unique_folder)
+
+    # (Optional) 5: Process end result
+    # In case the final result of the main application (see step 3) is _not_
+    # just a simple file, we should call another script here which processes
+    # this end result and writes into the /service/result.txt file.
+
+
+def generate_id(folder, size=16, chars=string.ascii_uppercase + string.digits):
+    """Generates a random ID string which guaranteed not to exist in a folder"""
+    while True:
+        ID = ''.join(random.choice(chars) for _ in range(size))
+        if not os.path.exists(os.path.join(folder, ID)):
+            break
+    return ID
+
+
+if __name__ == "__main__":
+    main()
\ No newline at end of file

CentOS/7.5-ESPRESO/app/wait_a_while.py

+import sys
+import time
+import datetime
+import json
+import os
+import logging
+
+logging.basicConfig(level=logging.INFO)
+logger = logging.getLogger("Waiter")
+
+
+def main():
+    seconds_to_wait = int(sys.argv[1])
+    fn_log = sys.argv[2]
+    fn_result = sys.argv[3]
+    fn_abort = sys.argv[4]
+    logger.info("Waiter starting up, will wait {} seconds".format(seconds_to_wait))
+    
+    for current_time in range(seconds_to_wait):
+        # Perform part of "complicated computation"
+        time.sleep(1)
+        
+        # Write log
+        write_log(fn_log, current_time, seconds_to_wait)
+
+        # Check if we should abort
+        if os.path.exists(fn_abort):
+            write_final_log(fn_log)
+            write_result(fn_result, current_time, aborted=True)
+            return 0
+    
+    write_final_log(fn_log)
+    write_result(fn_result, seconds_to_wait)
+
+
+def write_log(fn_log, elapsed_time, total_time):
+    log = {
+        'timestamp': str(datetime.datetime.now()),
+        'elapsed_time': str(elapsed_time),
+        'total_time': str(total_time),
+    }
+    with open(fn_log, 'a') as fout:
+        json.dump(log, fout)
+        fout.write("\n")
+    logger.info("Log written: {}/{} seconds waited".format(elapsed_time, total_time))
+
+
+def write_final_log(fn_log):
+    with open(fn_log, 'a') as fout:
+        fout.write("FINISHED\n")
+    logger.info("Final log written")
+
+
+def write_result(fn, seconds_waited, aborted=False):
+    with open(fn, 'w') as f:
+        if aborted:
+            f.write('Done. My waiting was aborted after {} seconds.'.format(seconds_waited))
+        else:
+            f.write('Done. I have waited {} seconds.'.format(seconds_waited))
+    logger.info("Result written")
+
+
+if __name__ == "__main__":
+    main()

CentOS/7.5-ESPRESO/heat.cpp

+# ESPRESO Configuration File
+
+#BENCHMARK ARG0 [ TETRA4, TETRA10, PYRAMID5, PYRAMID13, PRISMA6, PRISMA15, HEXA8, HEXA20 ]
+#BENCHMARK ARG10 [ TOTAL_FETI, HYBRID_FETI ]
+
+DEFAULT_ARGS {
+  0       HEXA8;
+
+  1           1;
+  2           1;
+  3           1;
+
+  4           2;
+  5           2;