search

AIRI-Institute / nablaDFT

nablaDFT: Large-Scale Conformational Energy and Hamiltonian Prediction benchmark and dataset
https://doi.org/10.1039/D2CP03966D
MIT License
150 stars 15 forks source link

Tutorial 0a #32

Closed KonstantinUshenin closed 2 weeks ago

KonstantinUshenin commented 3 weeks ago

There are the first tutorial.

KonstantinUshenin commented 3 weeks ago

Two tutorials in the examples folder