45888 packages found. Page 777 of 918.

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Name Version Votes Popularity? Description Maintainer
python-pyquante2-git r469.91a352b-1 0 0.00 Python Quantum Chemistry Reloaded. This is a rewrite of the standard PyQuante program to clean up things that have been nagging me. berquist
python-pylatex-git 1.2.2.r685.3642fd2-1 0 0.00 A Python library for creating LaTeX files (git version) berquist
python-chemview-git 0.3.r87.c7e9150-1 0 0.00 An interactive molecular viewer for the IPython notebook (git version) berquist
python-chemlab-git 0.4.1.r725.cc10e09-1 0 0.00 A general Python library for computational chemistry (git version) berquist
python-cclib-git 1.3.3.r1789.f72c8cd-1 0 0.00 A library for parsing and interpreting the results of computational chemistry packages. (git version) berquist
python-cclib 1.5.1-1 0 0.00 A library for parsing and interpreting the results of computational chemistry packages. berquist
psi3-bin 3.4.0.6-1 0 0.00 An open-source program for computing molecular properties using high-accuracy, ab initio, quantum mechanical models. (Debian binary build) berquist
packmol 16.320-2 0 0.00 Creates an initial point for molecular dynamics simulations by packing molecules in defined regions of space. berquist
openbabel-git 2.3.90.r4215.3dda994-1 2 0.00 A library designed to interconvert between many file formats used in molecular modeling and computational chemistry (git version, builds Python bindings) berquist
nwchem-git r28217.efdd7b6c36-1 0 0.00 Ab initio computational chemistry software package (SVN trunk via Git) berquist
nwchem-data 6.6.r27746.4-1 0 0.00 Open Source High-Performance Computational Chemistry (basis sets, FF params needed for Debian binary build) berquist
nwchem-bin 6.6.r27746.4-3 1 0.00 Open Source High-Performance Computational Chemistry (Debian binary build) berquist
molequeue-git 0.8.0.r792.0d6fbba-3 0 0.00 Desktop integration of high performance computing resources berquist
lua-posix-git 33.4.0.11.g3ab67b5-2 4 0.00 POSIX library for Lua berquist
lmod-git 7.0.4.r0.gd7b7636-1 0 0.00 An Environment Module System based on Lua, Reads TCL Modules, Supports a Software Hierarchy berquist
fftw2 2.1.5-1 3 0.01 A library for computing the discrete Fourier transform (DFT), major version 2, with OpenMPI berquist
cp2k-bin 5.1-1 1 0.06 A quantum chemistry and solid state physics software package for atomistic simulations of solid state, liquid, molecular, periodic, material, crystal, and biological systems. (precompiled, OpenMP) berquist
chemkit-git 1101-1 0 0.00 An open source software library for cheminformatics, molecular modeling and molecular visualization berquist
chemkit-builder-git 6-1 0 0.00 Lightweight molecular editor built using chemkit berquist
avogadrolibs-git 1.90.0.r1254.1f3c3bf-5 0 0.00 Avogadro 2: libraries berquist
avogadro2-git 1.90.0.r351.be6a31f-2 3 0.01 Avogadro 2: graphical application berquist
avogadro 1.2.0-5 7 0.44 An advanced molecular editor based on Qt berquist
x11-bell-gst-git r2.27459b6-2 0 0.00 It connects to a X11 server and plays SOUND_FILE by GStreamer when the XkbBellNotify event occurs. beroal
python2-template-toolkit-svn 170-1 0 0.00 Python port of the Perl Template Toolkit beroal
mozart2 2.0.0_alpha.0.4140-5 3 0.00 An open source implementation of Oz 3. beroal
mozart1-bin 1.4.0.20080704_16189-1 0 0.00 An open source implementation of Oz 3. beroal
modutils 2.4.27-3 0 0.00 Work with the Linux kernel modules beroal
microblog-purple2 0.4.1.1-1 2 0.00 Libpurple plug-in supporting microblog services like Twitter. beroal
libgcpp-svn 215421-1 0 0.00 The GNU C preprocessor internals. A shared object (so) library. beroal
lib32-tk85 8.5.19-1 1 0.00 A windowing toolkit for use with tcl, 8.5 series beroal
lib32-tcl85 8.5.19-1 1 0.00 The Tcl scripting language, 8.5 series beroal
glib2-sched-policy 2.30.0-1 0 0.00 Common C routines used by GTK+ and other libs. Patched to allow a multithreaded process to have a real time scheduling policy. beroal
firebird-odbc 2.0.4-1 1 0.01 An ODBC Driver for the Firebird RDBMS beroal
dyncall 0.9-1 0 0.00 Calls any plain C function with an argument list created dynamically. beroal
cnijfilter-e510 3.80-3 0 0.00 Canon IJ Printer Driver (For PIXMA E510 series) beroal
bittorrent2player 1.5-2 2 0.00 Transfers data from the BitTorrent network to another protocol (currently HTTP) which is more suitable for media players. beroal
binutils-tune-bfd-hash 2.22-3 0 0.00 A set of programs to assemble and manipulate binary and object files. 'ld' is patched for using with GHC, see http://www.haskell.org/pipermail/glasgow-haskell-users/2010-April/018722.html . beroal
azardi 43.1-1 1 0.01 The AZARDI book reader by Infogrid Pacific Pte Ltd. beroal
r8169aspm-dkms v1.1-2 2 0.87 Driver for Realtek Ethernet chips with aspm enabled for power saving berndkast
stegosaurus-lv2 0.0.3-2 2 0.00 lv2 drum synthersizer without sampling bergentroll
phrasebooks 1.0.2-1 1 0.00 English phrasebook that helps to learn language bergentroll
geany-jedi-complete 8eba66e8-1 2 0.11 A Geany plugin that provides Python code completion using jedi. bergentroll
cado-git 0.9.2-1 1 0.00 Capability DO (like a sudo providing users with just the capabilities they need)) berdav
udisksvm 2.6.2-1 25 0.06 GUI UDisks wrapper for removable media berbae
sudoku-savant 1.3-5 8 0.00 A GUI application to solve and generate sudoku puzzles through logical means berbae
ipager 1.1.0-11 37 0.00 a lightweight beautiful pager from Fluxbox berbae
freetuxtv-svn 0.6.8.r0.g66dda27-1 17 0.00 WebTV vlc player to watch tv/radio playlists on the internet berbae
freetuxtv 0.6.8-1 80 1.58 WebTV vlc player to watch tv/radio playlists on the internet berbae
vokabeltrainer-git 2:current-1 1 0.03 A small command-line vocable trainer that uses the Leitner box system. ber532k
tmux-xpanes 2.2.1-1 0 0.00 Create multiple panes with ultimate terminal divider. ber532k

45888 packages found. Page 777 of 918.

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