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muttukrish/gromacs-gpu-1 : gromacs
GPU capable image of Gromacs
Latest release: about 2 years ago - 8 downloads - 322 dependencies
JSONDependencies
- ubuntu/adduser 3.118ubuntu2
- ubuntu/apt 2.0.9
- ubuntu/autoconf 2.69-11.1
- ubuntu/automake 1:1.16.1-4ubuntu6
- ubuntu/autotools-dev 20180224.1
- ubuntu/base-files 11ubuntu5.6
- ubuntu/base-passwd 3.5.47
- ubuntu/bash 5.0-6ubuntu1.2
- ubuntu/binutils-common 2.34-6ubuntu1.4
- ubuntu/binutils-x86-64-linux-gnu 2.34-6ubuntu1.4
- ubuntu/binutils 2.34-6ubuntu1.4
- ubuntu/bsdutils 1:2.34-0.1ubuntu9.3
- ubuntu/build-essential 12.8ubuntu1.1
- ubuntu/bzip2 1.0.8-2
- ubuntu/ca-certificates 20211016ubuntu0.20.04.1
- ubuntu/cmake-data 3.16.3-1ubuntu1.20.04.1
- ubuntu/cmake 3.16.3-1ubuntu1.20.04.1
- ubuntu/coreutils 8.30-3ubuntu2
- ubuntu/cpp-9 9.4.0-1ubuntu1~20.04.1
- ubuntu/cpp 4:9.3.0-1ubuntu2
- ubuntu/cuda-cccl-12-0 12.0.90-1
- ubuntu/cuda-command-line-tools-12-0 12.0.0-1
- ubuntu/cuda-compat-12-0 525.60.13-1
- ubuntu/cuda-compiler-12-0 12.0.0-1
- ubuntu/cuda-cudart-12-0 12.0.107-1
- ubuntu/cuda-cudart-dev-12-0 12.0.107-1
- ubuntu/cuda-cuobjdump-12-0 12.0.76-1
- ubuntu/cuda-cupti-12-0 12.0.90-1
- ubuntu/cuda-cupti-dev-12-0 12.0.90-1
- ubuntu/cuda-cuxxfilt-12-0 12.0.76-1
- ubuntu/cuda-driver-dev-12-0 12.0.107-1
- ubuntu/cuda-gdb-12-0 12.0.90-1
- ubuntu/cuda-libraries-12-0 12.0.0-1
- ubuntu/cuda-libraries-dev-12-0 12.0.0-1
- ubuntu/cuda-minimal-build-12-0 12.0.0-1
- ubuntu/cuda-nvcc-12-0 12.0.76-1
- ubuntu/cuda-nvdisasm-12-0 12.0.76-1
- ubuntu/cuda-nvml-dev-12-0 12.0.76-1
- ubuntu/cuda-nvprof-12-0 12.0.90-1
- ubuntu/cuda-nvprune-12-0 12.0.76-1
- ubuntu/cuda-nvrtc-12-0 12.0.76-1
- ubuntu/cuda-nvrtc-dev-12-0 12.0.76-1
- ubuntu/cuda-nvtx-12-0 12.0.76-1
- ubuntu/cuda-opencl-12-0 12.0.76-1
- ubuntu/cuda-opencl-dev-12-0 12.0.76-1
- ubuntu/cuda-profiler-api-12-0 12.0.76-1
- ubuntu/cuda-sanitizer-12-0 12.0.90-1
- ubuntu/cuda-toolkit-12-0-config-common 12.0.107-1
- ubuntu/cuda-toolkit-12-config-common 12.0.107-1
- ubuntu/cuda-toolkit-config-common 12.0.107-1
- ubuntu/dash 0.5.10.2-6
- ubuntu/debconf 1.5.73
- ubuntu/debianutils 4.9.1
- ubuntu/diffutils 1:3.7-3
- ubuntu/dirmngr 2.2.19-3ubuntu2.2
- ubuntu/doxygen 1.8.17-0ubuntu2
- ubuntu/dpkg-dev 1.19.7ubuntu3.2
- ubuntu/dpkg 1.19.7ubuntu3.2
- ubuntu/e2fsprogs 1.45.5-2ubuntu1.1
- ubuntu/fdisk 2.34-0.1ubuntu9.3
- ubuntu/file 1:5.38-4
- ubuntu/findutils 4.7.0-1ubuntu1
- ubuntu/g -9 9.4.0-1ubuntu1~20.04.1
- ubuntu/g 4:9.3.0-1ubuntu2
- ubuntu/gcc-10-base 10.3.0-1ubuntu1~20.04
- ubuntu/gcc-9-base 9.4.0-1ubuntu1~20.04.1
- ubuntu/gcc-9 9.4.0-1ubuntu1~20.04.1
- ubuntu/gcc 4:9.3.0-1ubuntu2
- ubuntu/gfortran-9 9.4.0-1ubuntu1~20.04.1
- ubuntu/gfortran 4:9.3.0-1ubuntu2
- ubuntu/gnupg-l10n 2.2.19-3ubuntu2.2
- ubuntu/gnupg-utils 2.2.19-3ubuntu2.2
- ubuntu/gnupg2 2.2.19-3ubuntu2.2
- ubuntu/gnupg 2.2.19-3ubuntu2.2
- ubuntu/gpg-agent 2.2.19-3ubuntu2.2
- ubuntu/gpg-wks-client 2.2.19-3ubuntu2.2
- ubuntu/gpg-wks-server 2.2.19-3ubuntu2.2
- ubuntu/gpg 2.2.19-3ubuntu2.2
- ubuntu/gpgconf 2.2.19-3ubuntu2.2
- ubuntu/gpgsm 2.2.19-3ubuntu2.2
- ubuntu/gpgv 2.2.19-3ubuntu2.2
- ubuntu/grep 3.4-1
- ubuntu/gzip 1.10-0ubuntu4.1
- ubuntu/hostname 3.23
- ubuntu/ibverbs-providers 28.0-1ubuntu1
- ubuntu/init-system-helpers 1.57
- ubuntu/krb5-locales 1.17-6ubuntu4.1
- ubuntu/libacl1 2.2.53-6
- ubuntu/libapt-pkg6.0 2.0.9
- ubuntu/libarchive13 3.4.0-2ubuntu1.2
- ubuntu/libasan5 9.4.0-1ubuntu1~20.04.1
- ubuntu/libasn1-8-heimdal 7.7.0 dfsg-1ubuntu1.2
- ubuntu/libassuan0 2.5.3-7ubuntu2
- ubuntu/libatomic1 10.3.0-1ubuntu1~20.04
- ubuntu/libattr1 1:2.4.48-5
- ubuntu/libaudit-common 1:2.8.5-2ubuntu6
- ubuntu/libaudit1 1:2.8.5-2ubuntu6
- ubuntu/libbinutils 2.34-6ubuntu1.4
- ubuntu/libblkid1 2.34-0.1ubuntu9.3
- ubuntu/libbrotli1 1.0.7-6ubuntu0.1
- ubuntu/libbsd0 0.10.0-1
- ubuntu/libbz2-1.0 1.0.8-2
- ubuntu/libc-bin 2.31-0ubuntu9.9
- ubuntu/libc-dev-bin 2.31-0ubuntu9.9
- ubuntu/libc6-dev 2.31-0ubuntu9.9
- ubuntu/libc6 2.31-0ubuntu9.9
- ubuntu/libcaf-openmpi-3 2.8.0-1
- ubuntu/libcap-ng0 0.7.9-2.1build1
- ubuntu/libcbor0.6 0.6.0-0ubuntu1
- ubuntu/libcc1-0 10.3.0-1ubuntu1~20.04
- ubuntu/libclang1-10 1:10.0.0-4ubuntu1
- ubuntu/libcoarrays-dev 2.8.0-1
- ubuntu/libcoarrays-openmpi-dev 2.8.0-1
- ubuntu/libcom-err2 1.45.5-2ubuntu1.1
- ubuntu/libcrypt-dev 1:4.4.10-10ubuntu4
- ubuntu/libcrypt1 1:4.4.10-10ubuntu4
- ubuntu/libctf-nobfd0 2.34-6ubuntu1.4
- ubuntu/libctf0 2.34-6ubuntu1.4
- ubuntu/libcublas-12-0 12.0.1.189-1
- ubuntu/libcublas-dev-12-0 12.0.1.189-1
- ubuntu/libcufft-12-0 11.0.0.21-1
- ubuntu/libcufft-dev-12-0 11.0.0.21-1
- ubuntu/libcufile-12-0 1.5.0.59-1
- ubuntu/libcufile-dev-12-0 1.5.0.59-1
- ubuntu/libcurand-12-0 10.3.1.50-1
- ubuntu/libcurand-dev-12-0 10.3.1.50-1
- ubuntu/libcurl4 7.68.0-1ubuntu2.14
- ubuntu/libcusolver-12-0 11.4.2.57-1
- ubuntu/libcusolver-dev-12-0 11.4.2.57-1
- ubuntu/libcusparse-12-0 12.0.0.76-1
- ubuntu/libcusparse-dev-12-0 12.0.0.76-1
- ubuntu/libdb5.3 5.3.28 dfsg1-0.6ubuntu2
- ubuntu/libdebconfclient0 0.251ubuntu1
- ubuntu/libdpkg-perl 1.19.7ubuntu3.2
- ubuntu/libedit2 3.1-20191231-1
- ubuntu/libevent-2.1-7 2.1.11-stable-1
- ubuntu/libevent-core-2.1-7 2.1.11-stable-1
- ubuntu/libevent-dev 2.1.11-stable-1
- ubuntu/libevent-extra-2.1-7 2.1.11-stable-1
- ubuntu/libevent-openssl-2.1-7 2.1.11-stable-1
- ubuntu/libevent-pthreads-2.1-7 2.1.11-stable-1
- ubuntu/libexpat1 2.2.9-1ubuntu0.6
- ubuntu/libext2fs2 1.45.5-2ubuntu1.1
- ubuntu/libfabric1 1.6.2-3
- ubuntu/libfdisk1 2.34-0.1ubuntu9.3
- ubuntu/libffi7 3.3-4
- ubuntu/libfftw3-bin 3.3.8-2ubuntu1
- ubuntu/libfftw3-dev 3.3.8-2ubuntu1
- ubuntu/libfftw3-double3 3.3.8-2ubuntu1
- ubuntu/libfftw3-long3 3.3.8-2ubuntu1
- ubuntu/libfftw3-quad3 3.3.8-2ubuntu1
- ubuntu/libfftw3-single3 3.3.8-2ubuntu1
- ubuntu/libfido2-1 1.3.1-1ubuntu2
- ubuntu/libgcc-9-dev 9.4.0-1ubuntu1~20.04.1
- ubuntu/libgcc-s1 10.3.0-1ubuntu1~20.04
- ubuntu/libgcrypt20 1.8.5-5ubuntu1.1
- ubuntu/libgdbm-compat4 1.18.1-5
- ubuntu/libgdbm6 1.18.1-5
- ubuntu/libgfortran-9-dev 9.4.0-1ubuntu1~20.04.1
- ubuntu/libgfortran5 10.3.0-1ubuntu1~20.04
- ubuntu/libgmp10 2:6.2.0 dfsg-4ubuntu0.1
- ubuntu/libgnutls30 3.6.13-2ubuntu1.7
- ubuntu/libgomp1 10.3.0-1ubuntu1~20.04
- ubuntu/libgpg-error0 1.37-1
- ubuntu/libgssapi-krb5-2 1.17-6ubuntu4.1
- ubuntu/libgssapi3-heimdal 7.7.0 dfsg-1ubuntu1.2
- ubuntu/libhcrypto4-heimdal 7.7.0 dfsg-1ubuntu1.2
- ubuntu/libheimbase1-heimdal 7.7.0 dfsg-1ubuntu1.2
- ubuntu/libheimntlm0-heimdal 7.7.0 dfsg-1ubuntu1.2
- ubuntu/libhogweed5 3.5.1 really3.5.1-2ubuntu0.2
- ubuntu/libhwloc-dev 2.1.0 dfsg-4
- ubuntu/libhwloc-plugins 2.1.0 dfsg-4
- ubuntu/libhwloc15 2.1.0 dfsg-4
- ubuntu/libhx509-5-heimdal 7.7.0 dfsg-1ubuntu1.2
- ubuntu/libibverbs-dev 28.0-1ubuntu1
- ubuntu/libibverbs1 28.0-1ubuntu1
- ubuntu/libicu66 66.1-2ubuntu2.1
- ubuntu/libidn2-0 2.2.0-2
- ubuntu/libisl22 0.22.1-1
- ubuntu/libitm1 10.3.0-1ubuntu1~20.04
- ubuntu/libjsoncpp1 1.7.4-3.1ubuntu2
- ubuntu/libk5crypto3 1.17-6ubuntu4.1
- ubuntu/libkeyutils1 1.6-6ubuntu1.1
- ubuntu/libkrb5-26-heimdal 7.7.0 dfsg-1ubuntu1.2
- ubuntu/libkrb5-3 1.17-6ubuntu4.1
- ubuntu/libkrb5support0 1.17-6ubuntu4.1
- ubuntu/libksba8 1.3.5-2ubuntu0.20.04.1
- ubuntu/libldap-2.4-2 2.4.49 dfsg-2ubuntu1.9
- ubuntu/libldap-common 2.4.49 dfsg-2ubuntu1.9
- ubuntu/libllvm10 1:10.0.0-4ubuntu1
- ubuntu/liblsan0 10.3.0-1ubuntu1~20.04
- ubuntu/libltdl-dev 2.4.6-14
- ubuntu/libltdl7 2.4.6-14
- ubuntu/liblz4-1 1.9.2-2ubuntu0.20.04.1
- ubuntu/liblzma5 5.2.4-1ubuntu1.1
- ubuntu/libmagic-mgc 1:5.38-4
- ubuntu/libmagic1 1:5.38-4
- ubuntu/libmount1 2.34-0.1ubuntu9.3
- ubuntu/libmpc3 1.1.0-1
- ubuntu/libmpdec2 2.4.2-3
- ubuntu/libmpfr6 4.0.2-1
- ubuntu/libncurses6 6.2-0ubuntu2
- ubuntu/libncursesw5 6.2-0ubuntu2
- ubuntu/libncursesw6 6.2-0ubuntu2
- ubuntu/libnettle7 3.5.1 really3.5.1-2ubuntu0.2
- ubuntu/libnghttp2-14 1.40.0-1build1
- ubuntu/libnl-3-200 3.4.0-1
- ubuntu/libnl-3-dev 3.4.0-1
- ubuntu/libnl-route-3-200 3.4.0-1
- ubuntu/libnl-route-3-dev 3.4.0-1
- ubuntu/libnpp-12-0 12.0.0.30-1
- ubuntu/libnpp-dev-12-0 12.0.0.30-1
- ubuntu/libnpth0 1.6-1
- ubuntu/libnuma-dev 2.0.12-1
- ubuntu/libnuma1 2.0.12-1
- ubuntu/libnvjitlink-12-0 12.0.76-1
- ubuntu/libnvjitlink-dev-12-0 12.0.76-1
- ubuntu/libnvjpeg-12-0 12.0.0.28-1
- ubuntu/libnvjpeg-dev-12-0 12.0.0.28-1
- ubuntu/libopenmpi-dev 4.0.3-0ubuntu1
- ubuntu/libopenmpi3 4.0.3-0ubuntu1
- ubuntu/libp11-kit0 0.23.20-1ubuntu0.1
- ubuntu/libpam-modules-bin 1.3.1-5ubuntu4.3
- ubuntu/libpam-modules 1.3.1-5ubuntu4.3
- ubuntu/libpam-runtime 1.3.1-5ubuntu4.3
- ubuntu/libpam0g 1.3.1-5ubuntu4.3
- ubuntu/libpciaccess0 0.16-0ubuntu1
- ubuntu/libpcre2-8-0 10.34-7ubuntu0.1
- ubuntu/libpcre3 2:8.39-12ubuntu0.1
- ubuntu/libperl5.30 5.30.0-9ubuntu0.3
- ubuntu/libpmix2 3.1.5-1
- ubuntu/libprocps8 2:3.3.16-1ubuntu2.3
- ubuntu/libpsl5 0.21.0-1ubuntu1
- ubuntu/libpsm-infinipath1 3.3 20.604758e7-6
- ubuntu/libpsm2-2 11.2.86-1
- ubuntu/libpython3-stdlib 3.8.2-0ubuntu2
- ubuntu/libpython3.8-minimal 3.8.10-0ubuntu1~20.04.6
- ubuntu/libpython3.8-stdlib 3.8.10-0ubuntu1~20.04.6
- ubuntu/libquadmath0 10.3.0-1ubuntu1~20.04
- ubuntu/librdmacm1 28.0-1ubuntu1
- ubuntu/libreadline8 8.0-4
- ubuntu/librhash0 1.3.9-1
- ubuntu/libroken18-heimdal 7.7.0 dfsg-1ubuntu1.2
- ubuntu/librtmp1 2.4 20151223.gitfa8646d.1-2build1
- ubuntu/libsasl2-2 2.1.27 dfsg-2ubuntu0.1
- ubuntu/libsasl2-modules-db 2.1.27 dfsg-2ubuntu0.1
- ubuntu/libseccomp2 2.5.1-1ubuntu1~20.04.2
- ubuntu/libselinux1 3.0-1build2
- ubuntu/libsemanage-common 3.0-1build2
- ubuntu/libsemanage1 3.0-1build2
- ubuntu/libsepol1 3.0-1ubuntu0.1
- ubuntu/libsigsegv2 2.12-2
- ubuntu/libsmartcols1 2.34-0.1ubuntu9.3
- ubuntu/libsqlite3-0 3.31.1-4ubuntu0.5
- ubuntu/libss2 1.45.5-2ubuntu1.1
- ubuntu/libssh-4 0.9.3-2ubuntu2.2
- ubuntu/libssl1.1 1.1.1f-1ubuntu2.16
- ubuntu/libstdc -9-dev 9.4.0-1ubuntu1~20.04.1
- ubuntu/libstdc 6 10.3.0-1ubuntu1~20.04
- ubuntu/libsystemd0 245.4-4ubuntu3.19
- ubuntu/libtasn1-6 4.16.0-2
- ubuntu/libtinfo5 6.2-0ubuntu2
- ubuntu/libtinfo6 6.2-0ubuntu2
- ubuntu/libtool 2.4.6-14
- ubuntu/libtsan0 10.3.0-1ubuntu1~20.04
- ubuntu/libubsan1 10.3.0-1ubuntu1~20.04
- ubuntu/libudev1 245.4-4ubuntu3.19
- ubuntu/libunistring2 0.9.10-2
- ubuntu/libuuid1 2.34-0.1ubuntu9.3
- ubuntu/libuv1 1.34.2-1ubuntu1.3
- ubuntu/libwind0-heimdal 7.7.0 dfsg-1ubuntu1.2
- ubuntu/libx11-6 2:1.6.9-2ubuntu1.2
- ubuntu/libx11-data 2:1.6.9-2ubuntu1.2
- ubuntu/libxapian30 1.4.14-2
- ubuntu/libxau6 1:1.0.9-0ubuntu1
- ubuntu/libxcb1 1.14-2
- ubuntu/libxdmcp6 1:1.1.3-0ubuntu1
- ubuntu/libxext6 2:1.3.4-0ubuntu1
- ubuntu/libxml2 2.9.10 dfsg-5ubuntu0.20.04.5
- ubuntu/libxmuu1 2:1.1.3-0ubuntu1
- ubuntu/libxnvctrl0 525.60.13-0ubuntu1
- ubuntu/libzstd1 1.4.4 dfsg-3ubuntu0.1
- ubuntu/linux-libc-dev 5.4.0-135.152
- ubuntu/login 1:4.8.1-1ubuntu5.20.04.4
- ubuntu/logsave 1.45.5-2ubuntu1.1
- ubuntu/lsb-base 11.1.0ubuntu2
- ubuntu/m4 1.4.18-4
- ubuntu/make 4.2.1-1.2
- ubuntu/mawk 1.3.4.20200120-2
- ubuntu/mime-support 3.64ubuntu1
- ubuntu/mount 2.34-0.1ubuntu9.3
- ubuntu/ncurses-base 6.2-0ubuntu2
- ubuntu/ncurses-bin 6.2-0ubuntu2
- ubuntu/ocl-icd-libopencl1 2.2.11-1ubuntu1
- ubuntu/openmpi-bin 4.0.3-0ubuntu1
- ubuntu/openmpi-common 4.0.3-0ubuntu1
- ubuntu/openssh-client 1:8.2p1-4ubuntu0.5
- ubuntu/openssl 1.1.1f-1ubuntu2.16
- ubuntu/passwd 1:4.8.1-1ubuntu5.20.04.4
- ubuntu/patch 2.7.6-6
- ubuntu/perl-base 5.30.0-9ubuntu0.3
- ubuntu/perl-modules-5.30 5.30.0-9ubuntu0.3
- ubuntu/perl 5.30.0-9ubuntu0.3
- ubuntu/pinentry-curses 1.1.0-3build1
- ubuntu/procps 2:3.3.16-1ubuntu2.3
- ubuntu/publicsuffix 20200303.0012-1
- ubuntu/python3-minimal 3.8.2-0ubuntu2
- ubuntu/python3.8-minimal 3.8.10-0ubuntu1~20.04.6
- ubuntu/python3.8 3.8.10-0ubuntu1~20.04.6
- ubuntu/python3 3.8.2-0ubuntu2
- ubuntu/readline-common 8.0-4
- ubuntu/sed 4.7-1
- ubuntu/sensible-utils 0.0.12 nmu1
- ubuntu/sysvinit-utils 2.96-2.1ubuntu1
- ubuntu/tar 1.30 dfsg-7ubuntu0.20.04.2
- ubuntu/tzdata 2022g-0ubuntu0.20.04.1
- ubuntu/ubuntu-keyring 2020.02.11.4
- ubuntu/util-linux 2.34-0.1ubuntu9.3
- ubuntu/xauth 1:1.1-0ubuntu1
- ubuntu/xz-utils 5.2.4-1ubuntu1.1
- ubuntu/zlib1g 1:1.2.11.dfsg-2ubuntu1.5
- bash 5.0.17