A pip installer for guacamol_baselines?

[UnixJunkie]

This repository is a benchmark: people are supposed to be able to run it repeatably for years to come...
I wonder if providing a VM image with guacamol + guacamol_baselines properly co-installed
wouldn't be the best solution in the long run.

[JoshuaMeyers]

Hey @UnixJunkie, thanks for the suggestion. We provide a Dockerfile that allows you to recreate the environment in which the baselines were run, for guacamol_baselines this includes the exact versions of all dependencies.

For benchmarking your own models you only need to install guacamol from PyPI (version 0.5.4 will be released today)!

A pip installer for guacamol_baselines doesn't really make sense since baselines contains many implementations of baseline models, the underlying guacamol library is, however, pip installable.

[UnixJunkie]

Ok, thanks a lot for the detailed explanations.