mszep/occupation_diagrams
Produce a .svg occupation diagram from a textual CSF representation
Developer Profile
mszep
Discovered public repositories for mszep in the GitHub catalog.
mszep/turbomole_tools
Public repository.
mszep/www.docker.io
Docker's main website
mszep/hsdvi
parser for TeX's .dvi files, built from scratch emulating the binary parser in Real World Haskell.
mszep/elm_parsing
Public repository.
mszep/pyquante2
Python Quantum Chemistry Reloaded. This is a rewrite of the standard PyQuante program to clean up things that have been nagging me.
mszep/pyMECS
python implementation of the MECS formalism for discrete sites
mszep/times_tools
Some tools for preparing input files for the TIMES program
mszep/mcci
Monte Carlo Configuration Interaction
mszep/plot_tools
some numpy based plotting tools
mszep/csf_tools
Some tools for manipulating MCCI's civ_* files.
mszep/matrix_tools
tools for interop of fortran and numpy matrices
mszep/zeobuilder
Zeobuilder is an extensible GUI-toolkit for molecular model construction.
mszep/numba
NumPy aware dynamic Python compiler using LLVM
mszep/bibliography
Public repository.
mszep/chaincap
chaincap paper