Skip to content
View hkneiding's full-sized avatar
9 followers · 8 following

Block or report hkneiding

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.

Maximum 250 characters. Please don’t include any personal information such as legal names or email addresses. Markdown is supported. This note will only be visible to you.
Report abuse

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

Report abuse

Pinned Loading

  1. uiocompcat/tmQMg uiocompcat/tmQMg Public

    Repository for the tmQMg dataset files and analysis scripts.

    Python 18 7

  2. uiocompcat/tmQMg-L uiocompcat/tmQMg-L Public

    Repository for the tmQMg-L dataset files.

    Python 18 3

  3. uiocompcat/HyDGL uiocompcat/HyDGL Public

    Python parser for generating descriptive graphs from Natural Bond Orbital data ready for use in Graph Neural Networks.

    Python 14 4

  4. PL-MOGA PL-MOGA Public

    Pareto Lighthouse Multiobjective Genetic Algorithm for the de novo design of transition metal complexes.

    Python 5 1