Create your own GitHub profile
Sign up for your own profile on GitHub, the best place to host code, manage projects, and build software alongside 31 million developers.
Forked from qmlcode/qml
QML: Quantum Machine Learning
A collection of scripts for molecular dynamics simulations with BXD in energy space in 2D and 3D systems.
Forked from anderskm/gputil
A Python module for getting the GPU status from NVIDA GPUs using nvidia-smi programmically in Python
Supporting information for the publication about sampling of potential energy surfaces with VR and constrained MD.
TensorFlow workshop for the Centre for Computational Chemistry
in the last year
Press h to open a hovercard with more details.