Lester Hedges
Lester Hedges
> So I have not included anything from @annamherz's Frankenstein [feature-analysis](https://github.com/michellab/BioSimSpace/tree/feature-analysis) branch. It looks like this came in during the early sandpit synchronisation, i.e. when some of the edits from...
Sorry, I see this part has been removed. Just a general comment about variable names :-) On Fri, Nov 11, 2022 at 10:29 AM Zhiyi Wu ***@***.***> wrote: > ***@***.****...
Closing as this is now mostly implemented via Sire.
These functions now except `**kwargs`. Let me know if there are others places where this would be useful.
## Review checklist for @lohedges ### Conflict of interest - [x] I confirm that I have read the [JOSS conflict of interest (COI) policy](https://github.com/openjournals/joss/blob/master/COI.md) and that: I have no COIs...
@menoliu: Thanks for your updates. I've not had a chance to look at these yet and won't for the next week or so since I'm working to some tight deadlines.
Not yet, I'm afraid. I doubt I'll be able to do so until the middle/end of next week at the earliest, I'm afraid.
No, it's no longer relevant. I ended up selling the TB4 dock and reverting to using the TB3 versions, which works fine. Feel free to close.
@sri-vathsa: This is because `CELERY_BROKER` in the [env.env](https://github.com/bstiel/dockerize-celery-django-app/blob/master/env.env) file should read. `CELERY_BROKER_URL`.
When writing the Mol2 parser we decided not to attempt to infer the SYBYL atom type. This means that Mol2 files written by Sire following a format conversion can't be...