osmotic_transport_scaling_laws

Workflow for the calculation of osmotic transport coefficients from enhanced sampling simulations

sats4u

End-to-end Deep-Learning framework to accumulate satoshi's using live-algorithmic trading

abinitio-train

An end-to-end workflow to train neural network potentials and from ab initio molecular dynamics simulations

nequip-C-fortran-interface

Fortran - C/C++ interface for nequip