pypi.org : pynnsmd
Neural Network for learning potential energy surface for molecular dynamics.
Registry
-
Source
- Documentation
- JSON
purl: pkg:pypi/pynnsmd
Keywords:
materials
, science
, machine
, learning
, deep
, dynamics
, molecular
, potential
, ab-initio-simulations
, excited-states
, machine-learning
, molecular-dynamics
, neural-network
, potentials
License: MIT
Latest release: about 3 years ago
First release: about 4 years ago
Dependent repositories: 1
Downloads: 93 last month
Stars: 10 on GitHub
Forks: 6 on GitHub
See more repository details: repos.ecosyste.ms
Last synced: 11 days ago