atomistic-machine-learning
Pinned
Loading
SchNetPack - Deep Neural Networks for Atomistic Systems
Python
799
217
Repositories
Showing 8 of 8 repositories
schnetpack
Public
SchNetPack - Deep Neural Networks for Atomistic Systems
atomistic-machine-learning/schnetpack’s past year of commit activity
atomistic-machine-learning/schnetpack-gschnet’s past year of commit activity
Python
51
MIT
7
0
0
Updated Nov 7, 2024
cG-SchNet
Public
cG-SchNet - a conditional generative neural network for 3d molecular structures
atomistic-machine-learning/cG-SchNet’s past year of commit activity
Python
54
MIT
15
0
0
Updated Mar 24, 2023
G-SchNet
Public
G-SchNet - a generative model for 3d molecular structures
atomistic-machine-learning/G-SchNet’s past year of commit activity
Python
130
MIT
23
0
0
Updated Mar 24, 2023
atomistic-machine-learning/field_schnet’s past year of commit activity
Rich Text Format
19
4
1
0
Updated May 19, 2022
SchNOrb
Public
Unifying machine learning and quantum chemistry with a deep neural network for molecular wavefunctions
atomistic-machine-learning/SchNOrb’s past year of commit activity
Python
61
MIT
20
1
0
Updated Sep 17, 2019
SchNet
Public
SchNet - a deep learning architecture for quantum chemistry
atomistic-machine-learning/SchNet’s past year of commit activity
Python
233
MIT
67
1
0
Updated Sep 4, 2018
dtnn
Public
Deep Tensor Neural Network
atomistic-machine-learning/dtnn’s past year of commit activity
Python
78
MIT
31
0
0
Updated Jul 11, 2017
People
This organization has no public members. You must be a member to see who’s a part of this organization.
You can’t perform that action at this time.