Philipp Thölke
Philipp Thölke
I would say the API in this PR is more general and therefore preferable but I think it's still useful to keep e.g. the distinction between `prior_args` and `prior_init_args` from...
`BasePrior.forward()` returns the updated atomwise energy predictions, not only the prior contribution (see the `Atomref` prior as an example). It would be possible to add the prior divided by the...
### Multi-head implementation Yes, currently models can only have a single output head. I think adding multi-head support could be useful, however, requires changes to the current training interface and...
And yes, through the config file and model creation/loading you are currently limited to just one prior model, however, technically it would be possible to wrap the model in multiple...
You could simply pass `args` to the prior model in the same step as passing the dataset. If needed you could add an `initial_prior_args` of some sorts that can maybe...
Sounds good! I think version two is way more readable, which I think is what we should be going for in the config files. I reckon both versions will be...
Ah, sorry for the duplicate, moving to #2013.
Alright, since I can't reopen the other issues I'll stay here :D Any plans on addressing this issue? If you are sure that `mvCleanupViewport` provides the intended functionality I could...