hjjvandam

Brookhaven National LaboratoryUpton, NY

Pinned Repositories

cleanBib
Probabilistically assign gender and race proportions of first/last authors pairs in bibliography entries
Language:TeX0 0 00
CMakePackagingProject
A C++ dependency manager written in CMake
Language:CMake0 2 00
DeepDriveMD-pipeline
DeepDriveMD: Deep-Learning Driven Adaptive Molecular Simulations
Language:Python0 0 00
DeveloperTools
Documentation and tools for NWChemEx developers
Language:CMake0 2 00
diffpy-release
Scripts for building binary release bundle for Linux and Mac.
Language:Shell0 2 00
diffpy.srfit
framework for complex modeling and atomic structure optimization
Language:Python0 2 00
diffpy.srreal
Python library for PDF calculation and assortment of real-space utilities.
Language:C++00
diffpy.Structure
Crystal structure container and parsers for structure formats.
Language:Python0 2 00
nwchem-1
NWChem: Open Source High-Performance Computational Chemistry
Language:Fortran1 2 09
pyobjcryst
Python bindings to ObjCryst++ Object-Oriented Crystallographic Library
Language:C++1 2 00

hjjvandam/pyobjcryst
Python bindings to ObjCryst++ Object-Oriented Crystallographic Library
Language:C++1 2 00
hjjvandam/diffpy.srfit
framework for complex modeling and atomic structure optimization
Language:Python0 2 00
hjjvandam/diffpy.srreal
Python library for PDF calculation and assortment of real-space utilities.
Language:C++00
hjjvandam/diffpy.Structure
Crystal structure container and parsers for structure formats.
Language:Python0 2 00
hjjvandam/libdiffpy
DiffPy C++ library for calculation of PDF and other real-space quantities
Language:C++
hjjvandam/libobjcryst
ObjCryst++ re-packaged for installation as a shared library
Language:C++2 0
hjjvandam/QSTEM
STEM/TEM/Coherent CBED image simulations
Language:C++
hjjvandam/srfit-sasview
Modules from SasView needed by srfit. SasView builds can be found here: https://jenkins.esss.dk/sasview/
Language:Python