Skip to content
View davkovacs's full-sized avatar

Highlights

  • Pro

Block or report davkovacs

Block user

Prevent this user from interacting with your repositories and sending you notifications. Learn more about blocking users.

You must be logged in to block users.

Please don't include any personal information such as legal names or email addresses. Maximum 100 characters, markdown supported. This note will be visible to only you.
Report abuse

Contact GitHub support about this user’s behavior. Learn more about reporting abuse.

Report abuse

Popular repositories Loading

  1. BOTNet-datasets BOTNet-datasets Public

    This repo contains the datasets used for the paper The Design Space of E(3)-Equivariant Atom-Centered Interatomic Potentials.

    18 3

  2. MTExplainer MTExplainer Public

    This is an updated version of the MolecularTransformer of Schwaller et. al.

    Jupyter Notebook 13 4

  3. mace mace Public

    Forked from ACEsuit/mace

    MACE implementation in PyTorch

    Python 2 1

  4. Wang-Landau Wang-Landau Public

    quick implementation of the Wang-Landau sampling method to illustrate it's principles

    Python 1

  5. Huckel_MO_solver Huckel_MO_solver Public

    Part II Chemistry Programming Exercise 1

    Python

  6. Normal_frequency_calculator Normal_frequency_calculator Public

    Part II Chemistry Programming Exercise 2

    Python