Search results

Clean-up Marvel ICTP School recipes

Status: Open.

#270 In lab-cosmo/atomistic-cookbook;

· ppegolo opened on Jun 4, 2026

GROMACS example uses an incorrect implementation of ML/MM

Status: Open.

#241 In lab-cosmo/atomistic-cookbook;

· ceriottm opened on Mar 22, 2026

chore(deps): people don't remember how to stop downloading GPU torch

Status: Open.

#213 In lab-cosmo/atomistic-cookbook;

· HaoZeke opened on Jan 30, 2026

bug(plumed): needs a rebuild for newer lammps-metatomic

Status: Open.

#194 In lab-cosmo/atomistic-cookbook;

· HaoZeke opened on Dec 2, 2025

rfc: lockfiles for user reproducibility while testing "at the head"

Status: Open.

#190 In lab-cosmo/atomistic-cookbook;

· HaoZeke opened on Nov 4, 2025

rfc: speeding up with the oxidized python set

Status: Open.

#189 In lab-cosmo/atomistic-cookbook;

· HaoZeke opened on Nov 4, 2025

rfc: support micromamba

Status: Open.

#188 In lab-cosmo/atomistic-cookbook;

· HaoZeke opened on Nov 4, 2025

Add a metadata file to each example

Status: Open.

#185 In lab-cosmo/atomistic-cookbook;

· pfebrer opened on Oct 25, 2025

Update or remove the periodic-hamiltonian example

Status: Open.

#180 In lab-cosmo/atomistic-cookbook;

· Luthaf opened on Oct 13, 2025

Update or remove the lode-linear example

Status: Open.

#179 In lab-cosmo/atomistic-cookbook;

· Luthaf opened on Oct 13, 2025

MAINT: Integrate with custom feedstocks

enhancementNew feature or requestNew feature or request

Status: Open.

#152 In lab-cosmo/atomistic-cookbook;

· HaoZeke opened on Jun 18, 2025