View: jussilehtola's Info | jussilehtola's Packages (65)
Only packages with these acls:
IQmol -- A free open-source molecular editor and visualization package
PyQuante -- Python Quantum Chemistry
QMsgBox -- Solves a problem that prevents qt message icons from being displayed
QsLog -- An easy to use logger that is based on Qt's QDebug class
agedu -- An utility for tracking down wasted disk space
ape -- A tool for generating atomic pseudopotentials within a DFT framework
arpack -- Fortran77 subroutines for solving large scale eigenvalue problems
cnucnu -- Upstream release monitoring with bug reporting
cppcheck -- A tool for static C/C++ code analysis
dd_rescue -- Fault tolerant "dd" utility for rescuing data from bad media
ddrescue -- Data recovery tool trying hard to rescue data in case of read errors
dopewars -- A drug dealing game
efte -- A lightweight, extendable, folding text editor for X11
epson-inkjet-printer-escpr -- Drivers for Epson inkjet printers
epstool -- A utility to create or extract preview images in EPS files
ergo -- A program for large-scale self-consistent field calculations
fftw -- Fast Fourier Transform library
firehol -- A powerful yet easy to use iptables frontend
gdpc -- A program for visualising molecular dynamics simulations data
gle -- Graphics Layout Engine
gromacs -- GROMACS - Fast, Free and Flexible Molecular Dynamics
jaxodraw -- A Java program for drawing Feynman diagrams
jmol -- An open-source Java viewer for chemical structures in 3D
json-c -- A JSON implementation in C
jspecview -- JAVA applets for the display of JCAMP-DX and AnIML/CML spectral files
latex2rtf -- LaTeX to RTF converter that handles equations, figures, and cross-references
libint -- A library that evaluates integrals over Gaussian basis functions
libint2 -- A library for efficient evaluation of electron repulsion integrals
libxc -- Library of exchange and correlation functionals to be used in DFT codes
lis -- A library for solving linear equations and eigenvalue problems
mb2md -- Mailbox to maildir converter
mpiwrappers -- Environment module wrappers for MPI packages in RHEL
naga -- Simplified Java NIO asynchronous sockets
noip -- A dynamic DNS update client
octave -- A high-level language for numerical computations
octave-forge -- Contributed functions for octave
octave-gsl -- Octave bindings to the GNU Scientific Library
openbabel -- Chemistry software file format converter
openblas -- An optimized BLAS library based on GotoBLAS2
packmol -- Packing optimization for molecular dynamics simulations
pcc -- The Portable C Compiler
pdfchain -- A GUI for pdftk
perl-Net-UPnP -- Perl extension for UPnP
pidgin-latex -- Use LaTeX formulas in your pidgin conversations
pondus -- A personal weight management program
potrace -- Transform bitmaps into vector graphics
psi4 -- An ab initio quantum chemistry package
purple-msn-pecan -- Alternative MSN protocol plugin for libpurple
pygrace -- Python bindings for grace
pypar -- Parallel programming with Python
python-cclib -- A library for processing results of computational chemistry packages
python-mpmath -- A pure Python library for multiprecision floating-point arithmetic
python-paida -- Pure Python scientific analysis package
qd -- Double-Double and Quad-Double Arithmetic
qrupdate -- A Fortran library for fast updates of QR and Cholesky decompositions
rpmdepsize -- A tool for visualizing RPM dependencies
sympy -- A Python library for symbolic mathematics
towhee -- A Monte Carlo molecular simulation code
unetbootin -- Create bootable Live USB drives for a variety of Linux distributions
vecmath -- The 3D vector math Java package, javax.vecmath
vim-latex -- Tools to view, edit and compile LaTeX documents in Vim
votca-csg -- VOTCA coarse-graining engine
votca-tools -- VOTCA tools library
wannier90 -- Maximally-localised Wannier functions
xdrfile -- A small C-library for reading and writing GROMACS trr and xtc files