Awesome Open Source

Programming Languages

Search results for quantum molecular dynamics

molecular-dynamics x

8 search results found

Awesome Python Chemistry ⭐ 971

A curated list of Python packages related to chemistry

Mirror of the Quantum ESPRESSO repository. Please do not post Issues or pull requests here. Use gitlab.com/QEF/q-e instead.

Nanoengineer ⭐ 210

open-source nanotech CAD

Python library for reading, writing, and converting computational chemistry file formats and generating input files.

PROPhet is a code to integrate machine learning techniques with first-principles quantum chemistry approaches

Libra Code ⭐ 41

QXMD: Non-adiabatic Quantum Molecular Dynamics Simulation Engine

Q E Sirius ⭐ 6

SIRIUS-enabled Quantum ESPRESSO

Related Searches

Python Quantum (1,006)

Jupyter Notebook Quantum (494)

Circuit Quantum (332)

Quantum Qiskit (318)

C Plus Plus Quantum (277)

Python Molecular Dynamics (230)

Quantum Chemistry (176)

1-8 of 8 search results

Privacy | About | Terms | Follow Us On Twitter

Copyright 2018-2024 Awesome Open Source. All rights reserved.