dockerymh/protprep : gmx
Protein Preparation
Latest release: over 4 years ago - 236 downloads - 553 dependencies
JSONDependencies
- ubuntu/adduser 3.118ubuntu2
- ubuntu/apt 2.0.6
- ubuntu/autoconf 2.69-11.1
- ubuntu/automake 1:1.16.1-4ubuntu6
- ubuntu/autotools-dev 20180224.1
- ubuntu/base-files 11ubuntu5.4
- ubuntu/base-passwd 3.5.47
- ubuntu/bash 5.0-6ubuntu1.1
- ubuntu/binutils-common 2.34-6ubuntu1.3
- ubuntu/binutils-x86-64-linux-gnu 2.34-6ubuntu1.3
- ubuntu/binutils 2.34-6ubuntu1.3
- ubuntu/blt 2.5.3 dfsg-4
- ubuntu/bsdutils 1:2.34-0.1ubuntu9.1
- ubuntu/bzip2 1.0.8-2
- ubuntu/ca-certificates 20210119~20.04.2
- ubuntu/clustalw 2.1 lgpl-6build1
- ubuntu/cmake-data 3.16.3-1ubuntu1
- ubuntu/cmake 3.16.3-1ubuntu1
- ubuntu/coreutils 8.30-3ubuntu2
- ubuntu/cpp-9 9.3.0-17ubuntu1~20.04
- ubuntu/cpp 4:9.3.0-1ubuntu2
- ubuntu/dash 0.5.10.2-6
- ubuntu/debconf 1.5.73
- ubuntu/debianutils 4.9.1
- ubuntu/diffutils 1:3.7-3
- ubuntu/doxygen 1.8.17-0ubuntu2
- ubuntu/dpkg 1.19.7ubuntu3
- ubuntu/e2fsprogs 1.45.5-2ubuntu1
- ubuntu/fdisk 2.34-0.1ubuntu9.1
- ubuntu/file 1:5.38-4
- ubuntu/findutils 4.7.0-1ubuntu1
- ubuntu/fontconfig-config 2.13.1-2ubuntu3
- ubuntu/fonts-lyx 2.3.4.2-2
- ubuntu/fonts-mathjax 2.7.4 dfsg-1
- ubuntu/g -9 9.3.0-17ubuntu1~20.04
- ubuntu/g 4:9.3.0-1ubuntu2
- ubuntu/gcc-10-base 10.3.0-1ubuntu1~20.04
- ubuntu/gcc-9-base 9.3.0-17ubuntu1~20.04
- ubuntu/gcc-9 9.3.0-17ubuntu1~20.04
- ubuntu/gcc 4:9.3.0-1ubuntu2
- ubuntu/gfortran-9 9.3.0-17ubuntu1~20.04
- ubuntu/gfortran 4:9.3.0-1ubuntu2
- ubuntu/gpgv 2.2.19-3ubuntu2.1
- ubuntu/grep 3.4-1
- ubuntu/gromacs-data 2020.1-1
- ubuntu/gromacs 2020.1-1
- ubuntu/gzip 1.10-0ubuntu4
- ubuntu/hostname 3.23
- ubuntu/ibverbs-providers 28.0-1ubuntu1
- ubuntu/icu-devtools 66.1-2ubuntu2.1
- ubuntu/init-system-helpers 1.57
- ubuntu/javascript-common 11
- ubuntu/krb5-locales 1.17-6ubuntu4.1
- ubuntu/libacl1 2.2.53-6
- ubuntu/libaec0 1.0.4-1
- ubuntu/libapt-pkg6.0 2.0.6
- ubuntu/libarchive13 3.4.0-2ubuntu1
- ubuntu/libasan5 9.3.0-17ubuntu1~20.04
- ubuntu/libasn1-8-heimdal 7.7.0 dfsg-1ubuntu1
- 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 2.34-6ubuntu1.3
- ubuntu/libblas3 3.9.0-1build1
- ubuntu/libblkid1 2.34-0.1ubuntu9.1
- ubuntu/libblosc1 1.17.1 ds1-1
- ubuntu/libboost-all-dev 1.71.0.0ubuntu2
- ubuntu/libboost-atomic-dev 1.71.0.0ubuntu2
- ubuntu/libboost-atomic1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-atomic1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-chrono-dev 1.71.0.0ubuntu2
- ubuntu/libboost-chrono1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-chrono1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-container-dev 1.71.0.0ubuntu2
- ubuntu/libboost-container1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-container1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-context-dev 1.71.0.0ubuntu2
- ubuntu/libboost-context1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-context1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-coroutine-dev 1.71.0.0ubuntu2
- ubuntu/libboost-coroutine1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-coroutine1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-date-time-dev 1.71.0.0ubuntu2
- ubuntu/libboost-date-time1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-date-time1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-dev 1.71.0.0ubuntu2
- ubuntu/libboost-exception-dev 1.71.0.0ubuntu2
- ubuntu/libboost-exception1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-fiber-dev 1.71.0.0ubuntu2
- ubuntu/libboost-fiber1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-fiber1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-filesystem-dev 1.71.0.0ubuntu2
- ubuntu/libboost-filesystem1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-filesystem1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-graph-dev 1.71.0.0ubuntu2
- ubuntu/libboost-graph-parallel-dev 1.71.0.0ubuntu2
- ubuntu/libboost-graph-parallel1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-graph-parallel1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-graph1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-graph1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-iostreams-dev 1.71.0.0ubuntu2
- ubuntu/libboost-iostreams1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-iostreams1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-locale-dev 1.71.0.0ubuntu2
- ubuntu/libboost-locale1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-locale1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-log-dev 1.71.0.0ubuntu2
- ubuntu/libboost-log1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-log1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-math-dev 1.71.0.0ubuntu2
- ubuntu/libboost-math1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-math1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-mpi-dev 1.71.0.0ubuntu2
- ubuntu/libboost-mpi-python-dev 1.71.0.0ubuntu2
- ubuntu/libboost-mpi-python1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-mpi-python1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-mpi1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-mpi1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-numpy-dev 1.71.0.0ubuntu2
- ubuntu/libboost-numpy1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-numpy1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-program-options-dev 1.71.0.0ubuntu2
- ubuntu/libboost-program-options1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-program-options1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-python-dev 1.71.0.0ubuntu2
- ubuntu/libboost-python1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-python1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-random-dev 1.71.0.0ubuntu2
- ubuntu/libboost-random1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-random1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-regex-dev 1.71.0.0ubuntu2
- ubuntu/libboost-regex1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-regex1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-serialization-dev 1.71.0.0ubuntu2
- ubuntu/libboost-serialization1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-serialization1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-stacktrace-dev 1.71.0.0ubuntu2
- ubuntu/libboost-stacktrace1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-stacktrace1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-system-dev 1.71.0.0ubuntu2
- ubuntu/libboost-system1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-system1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-test-dev 1.71.0.0ubuntu2
- ubuntu/libboost-test1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-test1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-thread-dev 1.71.0.0ubuntu2
- ubuntu/libboost-thread1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-thread1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-timer-dev 1.71.0.0ubuntu2
- ubuntu/libboost-timer1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-timer1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-tools-dev 1.71.0.0ubuntu2
- ubuntu/libboost-type-erasure-dev 1.71.0.0ubuntu2
- ubuntu/libboost-type-erasure1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-type-erasure1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost-wave-dev 1.71.0.0ubuntu2
- ubuntu/libboost-wave1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost-wave1.71.0 1.71.0-6ubuntu6
- ubuntu/libboost1.71-dev 1.71.0-6ubuntu6
- ubuntu/libboost1.71-tools-dev 1.71.0-6ubuntu6
- ubuntu/libbrotli1 1.0.7-6ubuntu0.1
- ubuntu/libbsd0 0.10.0-1
- ubuntu/libbz2-1.0 1.0.8-2
- ubuntu/libc-bin 2.31-0ubuntu9.2
- ubuntu/libc-dev-bin 2.31-0ubuntu9.2
- ubuntu/libc6-dev 2.31-0ubuntu9.2
- ubuntu/libc6 2.31-0ubuntu9.2
- 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
- ubuntu/libcrypt-dev 1:4.4.10-10ubuntu4
- ubuntu/libcrypt1 1:4.4.10-10ubuntu4
- ubuntu/libctf-nobfd0 2.34-6ubuntu1.3
- ubuntu/libctf0 2.34-6ubuntu1.3
- ubuntu/libcurl4 7.68.0-1ubuntu2.7
- ubuntu/libdb5.3 5.3.28 dfsg1-0.6ubuntu2
- ubuntu/libdebconfclient0 0.251ubuntu1
- ubuntu/libdpkg-perl 1.19.7ubuntu3
- ubuntu/libedit2 3.1-20191231-1
- ubuntu/libeigen3-dev 3.3.7-2
- 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-dev 2.2.9-1build1
- ubuntu/libexpat1 2.2.9-1build1
- ubuntu/libext2fs2 1.45.5-2ubuntu1
- ubuntu/libfabric1 1.6.2-3
- ubuntu/libfdisk1 2.34-0.1ubuntu9.1
- 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/libfile-fcntllock-perl 0.22-3build4
- ubuntu/libfontconfig1 2.13.1-2ubuntu3
- ubuntu/libfreetype6 2.10.1-2ubuntu0.1
- ubuntu/libgcc-9-dev 9.3.0-17ubuntu1~20.04
- 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 9.3.0-17ubuntu1~20.04
- ubuntu/libgfortran5 10.3.0-1ubuntu1~20.04
- ubuntu/libglib2.0-0 2.64.6-1~ubuntu20.04.4
- ubuntu/libglib2.0-data 2.64.6-1~ubuntu20.04.4
- ubuntu/libgmp10 2:6.2.0 dfsg-4
- ubuntu/libgnutls30 3.6.13-2ubuntu1.6
- ubuntu/libgomp1 10.3.0-1ubuntu1~20.04
- ubuntu/libgpg-error0 1.37-1
- ubuntu/libgromacs5 2020.1-1
- ubuntu/libgssapi-krb5-2 1.17-6ubuntu4.1
- ubuntu/libgssapi3-heimdal 7.7.0 dfsg-1ubuntu1
- ubuntu/libhcrypto4-heimdal 7.7.0 dfsg-1ubuntu1
- ubuntu/libhdf5-103 1.10.4 repack-11ubuntu1
- ubuntu/libheimbase1-heimdal 7.7.0 dfsg-1ubuntu1
- ubuntu/libheimntlm0-heimdal 7.7.0 dfsg-1ubuntu1
- 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
- ubuntu/libibverbs-dev 28.0-1ubuntu1
- ubuntu/libibverbs1 28.0-1ubuntu1
- ubuntu/libicu-dev 66.1-2ubuntu2.1
- ubuntu/libicu66 66.1-2ubuntu2.1
- ubuntu/libidn2-0 2.2.0-2
- ubuntu/libimagequant0 2.12.2-1.1
- ubuntu/libisl22 0.22.1-1
- ubuntu/libitm1 10.3.0-1ubuntu1~20.04
- ubuntu/libjbig-dev 2.1-3.1build1
- ubuntu/libjbig0 2.1-3.1build1
- ubuntu/libjpeg-dev 8c-2ubuntu8
- ubuntu/libjpeg-turbo8-dev 2.0.3-0ubuntu1.20.04.1
- ubuntu/libjpeg-turbo8 2.0.3-0ubuntu1.20.04.1
- ubuntu/libjpeg8-dev 8c-2ubuntu8
- ubuntu/libjpeg8 8c-2ubuntu8
- ubuntu/libjs-jquery-ui 1.12.1 dfsg-5
- ubuntu/libjs-jquery 3.3.1~dfsg-3
- ubuntu/libjs-mathjax 2.7.4 dfsg-1
- ubuntu/libjsoncpp1 1.7.4-3.1ubuntu2
- ubuntu/libk5crypto3 1.17-6ubuntu4.1
- ubuntu/libkeyutils1 1.6-6ubuntu1
- ubuntu/libkrb5-26-heimdal 7.7.0 dfsg-1ubuntu1
- ubuntu/libkrb5-3 1.17-6ubuntu4.1
- ubuntu/libkrb5support0 1.17-6ubuntu4.1
- ubuntu/liblapack3 3.9.0-1build1
- ubuntu/liblbfgsb0 3.0 dfsg.3-7build1
- ubuntu/liblcms2-2 2.9-4
- ubuntu/libldap-2.4-2 2.4.49 dfsg-2ubuntu1.8
- ubuntu/libldap-common 2.4.49 dfsg-2ubuntu1.8
- ubuntu/libllvm10 1:10.0.0-4ubuntu1
- ubuntu/liblocale-gettext-perl 1.07-4
- 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/liblzma-dev 5.2.4-1ubuntu1
- ubuntu/liblzma5 5.2.4-1ubuntu1
- ubuntu/liblzo2-2 2.10-2
- ubuntu/libmagic-mgc 1:5.38-4
- ubuntu/libmagic1 1:5.38-4
- ubuntu/libmount1 2.34-0.1ubuntu9.1
- ubuntu/libmpc3 1.1.0-1
- ubuntu/libmpdec2 2.4.2-3
- ubuntu/libmpfr6 4.0.2-1
- ubuntu/libncurses6 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/libnuma-dev 2.0.12-1
- ubuntu/libnuma1 2.0.12-1
- 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 10.34-7
- ubuntu/libpcre3 2:8.39-12build1
- ubuntu/libperl5.30 5.30.0-9ubuntu0.2
- ubuntu/libpmix2 3.1.5-1
- ubuntu/libpng-dev 1.6.37-2
- ubuntu/libpng-tools 1.6.37-2
- ubuntu/libpng16-16 1.6.37-2
- 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/libpython2-dev 2.7.17-2ubuntu4
- ubuntu/libpython2-stdlib 2.7.17-2ubuntu4
- ubuntu/libpython2.7-dev 2.7.18-1~20.04.1
- ubuntu/libpython2.7-minimal 2.7.18-1~20.04.1
- ubuntu/libpython2.7-stdlib 2.7.18-1~20.04.1
- ubuntu/libpython2.7 2.7.18-1~20.04.1
- ubuntu/libpython3-dev 3.8.2-0ubuntu2
- ubuntu/libpython3-stdlib 3.8.2-0ubuntu2
- ubuntu/libpython3.8-dev 3.8.10-0ubuntu1~20.04.2
- ubuntu/libpython3.8-minimal 3.8.10-0ubuntu1~20.04.2
- ubuntu/libpython3.8-stdlib 3.8.10-0ubuntu1~20.04.2
- ubuntu/libpython3.8 3.8.10-0ubuntu1~20.04.2
- 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
- ubuntu/librtmp1 2.4 20151223.gitfa8646d.1-2build1
- ubuntu/libsasl2-2 2.1.27 dfsg-2
- ubuntu/libsasl2-modules-db 2.1.27 dfsg-2
- ubuntu/libsasl2-modules 2.1.27 dfsg-2
- 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 3.0-1
- ubuntu/libsigsegv2 2.12-2
- ubuntu/libsmartcols1 2.34-0.1ubuntu9.1
- ubuntu/libsnappy1v5 1.1.8-1build1
- ubuntu/libsqlite3-0 3.31.1-4ubuntu0.2
- ubuntu/libsqlite3-dev 3.31.1-4ubuntu0.2
- ubuntu/libss2 1.45.5-2ubuntu1
- ubuntu/libssh-4 0.9.3-2ubuntu2.2
- ubuntu/libssl1.1 1.1.1f-1ubuntu2.10
- ubuntu/libstdc -9-dev 9.3.0-17ubuntu1~20.04
- ubuntu/libstdc 6 10.3.0-1ubuntu1~20.04
- ubuntu/libsystemd0 245.4-4ubuntu3.14
- ubuntu/libsz2 1.0.4-1
- ubuntu/libtasn1-6 4.16.0-2
- ubuntu/libtcl8.6 8.6.10 dfsg-1
- ubuntu/libtiff-dev 4.1.0 git191117-2ubuntu0.20.04.2
- ubuntu/libtiff5 4.1.0 git191117-2ubuntu0.20.04.2
- ubuntu/libtiffxx5 4.1.0 git191117-2ubuntu0.20.04.2
- ubuntu/libtinfo6 6.2-0ubuntu2
- ubuntu/libtk8.6 8.6.10-1
- ubuntu/libtool 2.4.6-14
- ubuntu/libtsan0 10.3.0-1ubuntu1~20.04
- ubuntu/libubsan1 10.3.0-1ubuntu1~20.04
- ubuntu/libudev1 245.4-4ubuntu3.14
- ubuntu/libunistring2 0.9.10-2
- ubuntu/libuuid1 2.34-0.1ubuntu9.1
- ubuntu/libuv1 1.34.2-1ubuntu1.3
- ubuntu/libwebp6 0.6.1-2ubuntu0.20.04.1
- ubuntu/libwebpdemux2 0.6.1-2ubuntu0.20.04.1
- ubuntu/libwebpmux3 0.6.1-2ubuntu0.20.04.1
- ubuntu/libwind0-heimdal 7.7.0 dfsg-1ubuntu1
- 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/libxft2 2.3.3-0ubuntu1
- ubuntu/libxml2 2.9.10 dfsg-5ubuntu0.20.04.1
- ubuntu/libxmuu1 2:1.1.3-0ubuntu1
- ubuntu/libxnvctrl0 470.57.01-0ubuntu0.20.04.2
- ubuntu/libxrender1 1:0.9.10-1
- ubuntu/libxslt1.1 1.1.34-4
- ubuntu/libxss1 1:1.2.3-1
- ubuntu/libzstd1 1.4.4 dfsg-3ubuntu0.1
- ubuntu/linux-libc-dev 5.4.0-94.106
- ubuntu/locales 2.31-0ubuntu9.2
- ubuntu/login 1:4.8.1-1ubuntu5.20.04.1
- ubuntu/logsave 1.45.5-2ubuntu1
- ubuntu/lsb-base 11.1.0ubuntu2
- ubuntu/m4 1.4.18-4
- ubuntu/make 4.2.1-1.2
- ubuntu/manpages-dev 5.05-1
- ubuntu/manpages 5.05-1
- ubuntu/mawk 1.3.4.20200120-2
- ubuntu/mime-support 3.64ubuntu1
- ubuntu/mount 2.34-0.1ubuntu9.1
- ubuntu/mpi-default-bin 1.13
- ubuntu/mpi-default-dev 1.13
- ubuntu/ncurses-base 6.2-0ubuntu2
- ubuntu/ncurses-bin 6.2-0ubuntu2
- ubuntu/netbase 6.1
- 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 1:8.2p1-4ubuntu0.4
- ubuntu/openssl 1.1.1f-1ubuntu2.10
- ubuntu/passwd 1:4.8.1-1ubuntu5.20.04.1
- ubuntu/perl-base 5.30.0-9ubuntu0.2
- ubuntu/perl-modules-5.30 5.30.0-9ubuntu0.2
- ubuntu/perl 5.30.0-9ubuntu0.2
- ubuntu/pkg-config 0.29.1-0ubuntu4
- ubuntu/procps 2:3.3.16-1ubuntu2.3
- ubuntu/publicsuffix 20200303.0012-1
- ubuntu/python-enum34 1.1.6-2ubuntu1
- ubuntu/python-matplotlib-data 3.1.2-1ubuntu4
- ubuntu/python-sip-dev 4.19.21 dfsg-1build1
- ubuntu/python-sip 4.19.21 dfsg-1build1
- ubuntu/python-tables-data 3.6.1-2build1
- ubuntu/python2-dev 2.7.17-2ubuntu4
- ubuntu/python2-minimal 2.7.17-2ubuntu4
- ubuntu/python2.7-dev 2.7.18-1~20.04.1
- ubuntu/python2.7-minimal 2.7.18-1~20.04.1
- ubuntu/python2.7 2.7.18-1~20.04.1
- ubuntu/python2 2.7.17-2ubuntu4
- ubuntu/python3-all 3.8.2-0ubuntu2
- ubuntu/python3-atomicwrites 1.1.5-2build1
- ubuntu/python3-attr 19.3.0-2
- ubuntu/python3-bs4 4.8.2-1
- ubuntu/python3-chardet 3.0.4-4build1
- ubuntu/python3-cycler 0.10.0-3
- ubuntu/python3-dateutil 2.7.3-3ubuntu1
- ubuntu/python3-decorator 4.4.2-0ubuntu1
- ubuntu/python3-dev 3.8.2-0ubuntu2
- ubuntu/python3-distutils 3.8.10-0ubuntu1~20.04
- ubuntu/python3-et-xmlfile 1.0.1-2.1
- ubuntu/python3-html5lib 1.0.1-2
- ubuntu/python3-importlib-metadata 1.5.0-1
- ubuntu/python3-jdcal 1.0-1.3
- ubuntu/python3-kiwisolver 1.0.1-3build1
- ubuntu/python3-lib2to3 3.8.10-0ubuntu1~20.04
- ubuntu/python3-lxml 4.5.0-1ubuntu0.5
- ubuntu/python3-matplotlib 3.1.2-1ubuntu4
- ubuntu/python3-minimal 3.8.2-0ubuntu2
- ubuntu/python3-more-itertools 4.2.0-1build1
- ubuntu/python3-numexpr 2.7.1-1build1
- ubuntu/python3-numpy 1:1.17.4-5ubuntu3
- ubuntu/python3-olefile 0.46-2
- ubuntu/python3-openpyxl 3.0.3-1
- ubuntu/python3-packaging 20.3-1
- ubuntu/python3-pandas-lib 0.25.3 dfsg-7
- ubuntu/python3-pandas 0.25.3 dfsg-7
- ubuntu/python3-pil 7.0.0-4ubuntu0.4
- ubuntu/python3-pkg-resources 45.2.0-1
- ubuntu/python3-pluggy 0.13.0-2
- ubuntu/python3-py 1.8.1-1ubuntu0.1
- ubuntu/python3-pyparsing 2.4.6-1
- ubuntu/python3-pytest 4.6.9-1
- ubuntu/python3-scipy 1.3.3-3build1
- ubuntu/python3-setuptools 45.2.0-1
- ubuntu/python3-six 1.14.0-2
- ubuntu/python3-soupsieve 1.9.5 dfsg-1
- ubuntu/python3-tables-lib 3.6.1-2build1
- ubuntu/python3-tables 3.6.1-2build1
- ubuntu/python3-tk 3.8.10-0ubuntu1~20.04
- ubuntu/python3-tz 2019.3-1
- ubuntu/python3-wcwidth 0.1.8 dfsg1-3
- ubuntu/python3-webencodings 0.5.1-1ubuntu1
- ubuntu/python3-xlrd 1.1.0-5
- ubuntu/python3-xlwt 1.3.0-3
- ubuntu/python3-zipp 1.0.0-1
- ubuntu/python3.8-dev 3.8.10-0ubuntu1~20.04.2
- ubuntu/python3.8-minimal 3.8.10-0ubuntu1~20.04.2
- ubuntu/python3.8 3.8.10-0ubuntu1~20.04.2
- 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/shared-mime-info 1.15-1
- ubuntu/sip-dev 4.19.21 dfsg-1build1
- ubuntu/swig4.0 4.0.1-5build1
- ubuntu/swig 4.0.1-5build1
- ubuntu/sysvinit-utils 2.96-2.1ubuntu1
- ubuntu/tar 1.30 dfsg-7ubuntu0.20.04.1
- ubuntu/tk8.6-blt2.5 2.5.3 dfsg-4
- ubuntu/ttf-bitstream-vera 1.10-8
- ubuntu/tzdata 2021e-0ubuntu0.20.04
- ubuntu/ubuntu-keyring 2020.02.11.4
- ubuntu/ucf 3.0038 nmu1
- ubuntu/util-linux 2.34-0.1ubuntu9.1
- ubuntu/wget 1.20.3-1ubuntu2
- ubuntu/x11-common 1:7.7 19ubuntu14
- ubuntu/xauth 1:1.1-0ubuntu1
- ubuntu/xdg-user-dirs 0.17-2ubuntu1
- ubuntu/xz-utils 5.2.4-1ubuntu1
- ubuntu/zlib1g-dev 1:1.2.11.dfsg-2ubuntu1.2
- ubuntu/zlib1g 1:1.2.11.dfsg-2ubuntu1.2
- bash 5.0.17
- Cython 0.29.26
- GridDataFormats 0.6.0
- MDAnalysis 2.0.0
- OpenMM 7.5.0
- Pillow 7.0.0
- argparse 1.2.1
- atomicwrites 1.1.5
- attrs 19.3.0
- beautifulsoup4 4.8.2
- biopython 1.79
- certifi 2021.10.8
- chardet 3.0.4
- charset-normalizer 2.0.10
- cycler 0.10.0
- decorator 4.4.2
- docutils 0.17.1
- enum34 1.1.6
- et-xmlfile 1.0.1
- gsd 2.5.1
- html5lib 1.0.1
- idna 3.3
- importlib-metadata 1.5.0
- jdcal 1.0
- joblib 1.1.0
- kiwisolver 1.0.1
- lxml 4.5.0
- matplotlib 3.1.2
- mmcif-pdbx 2.0.1
- mmtf-python 1.1.2
- more-itertools 4.2.0
- msgpack 1.0.3
- networkx 2.6.3
- numexpr 2.7.1
- numpy 1.17.4
- olefile 0.46
- openpyxl 3.0.3
- packaging 20.3
- pandas 0.25.3
- pdb2pqr 3.5.0
- pip 21.3.1
- pluggy 0.13.0
- propka 3.4.0
- py 1.8.1
- pyparsing 2.4.6
- pytest 4.6.9
- python-dateutil 2.7.3
- pytz 2019.3
- requests 2.27.1
- scipy 1.3.3
- setuptools 45.2.0
- sip 4.19.21
- six 1.14.0
- soupsieve 1.9.5
- tables 3.6.1
- threadpoolctl 3.0.0
- tqdm 4.62.3
- urllib3 1.26.8
- wcwidth 0.1.8
- webencodings 0.5.1
- wsgiref 0.1.2
- xlrd 1.1.0
- xlwt 1.3.0
- zipp 1.0.0