Ecosyste.ms: Packages
An open API service providing package, version and dependency metadata of many open source software ecosystems and registries.
pypi.org "excited-states" keyword
kimonet 0.1.4
kimonet module5 versions - Latest release: about 2 years ago - 1 dependent repositories - 87 downloads last month - 1 stars on GitHub - 1 maintainer
pynnsmd 2.0.0
Neural Network for learning potential energy surface for molecular dynamics.3 versions - Latest release: about 2 years ago - 1 dependent repositories - 27 downloads last month - 10 stars on GitHub - 1 maintainer
pysisyphus 0.7.6
Python suite for exploring potential energy surfaces.42 versions - Latest release: about 2 years ago - 1 dependent repositories - 419 downloads last month - 88 stars on GitHub - 1 maintainer
Related Keywords
diffusion
1
kinetic-monte-carlo
1
python
1
materials
1
science
1
machine
1
learning
1
deep
1
dynamics
1
molecular
1
potential
1
ab-initio-simulations
1
machine-learning
1
molecular-dynamics
1
neural-network
1
potentials
1
intrinsic-reaction-coordinate
1
optimization
1
quantum-chemistry
1
transition-states
1