mlevant's Stars
google-deepmind/alphafold
Open source code for AlphaFold 2.
casualsnek/cassowary
Run Windows Applications on Linux as if they are native, Use linux applications to launch files files located in windows vm without needing to install applications on vm. With easy to use configuration GUI
Sterncat/opticspy
python optics module
prody/ProDy
A Python Package for Protein Dynamics Analysis
DCC-Lab/RayTracing
Simple ray tracing library in Python for optical design that considers simple optical elements (with ABCD ray matrices) but also finite diameters of elements to calculate aperture and field stops, field of view, etc... Useful to validate the design of an optical system (lenses positions, power and diameters). Also permits the propagation of gaussian laser beams through the same elements.
pkienzle/periodictable
Extensible periodic table for python
tschoonj/xraylib
A library for X-ray matter interaction cross sections for X-ray fluorescence applications
Electrostatics/apbs-pdb2pqr
APBS - software for biomolecular electrostatics and solvation
kklmn/xrt
Package xrt (XRayTracer) is a python software library for ray tracing and wave propagation in x-ray regime. It is primarily meant for modeling synchrotron sources, beamlines and beamline elements.
wojdyr/debyer
Debye's scattering equation & other analysis of atomistic models.
xraypy/XrayDB
X-ray Reference Data in SQLite library, including Python interface
Zelenyy/nist-calculators
Python implementaion of some NIST calculators
bjheinen/LiquidDiffract
LiquidDiffract is a GUI program to process experimental X-ray diffraction data of liquids/amorphous solids.
sstoupin/dtxrd
Tools for X-ray diffraction evaluation of single crystals
namdinator/Namdinator_bash
Bash version of Namdinator
kif/pyFAI
Fast Azimuthal Integration in Python
marcocamma/trx
Simple tools to work on time resolved X-ray data (averaging, subtraction of ground state signal, etc)