Andrew S. Rosen

Results 101 comments of Andrew S. Rosen

> yea, in the first pass (i think i ran out of walltime for some of them (in either featurization or hash computation), currently rerunning). If there are still thousands...

@kjappelbaum: I changed the title of this issue so this can be a place to continue discussing hosting of the QMOF data on MPContribs (in parallel with your `mofdscribe` data...

Thank you! I will keep you posted. I hope to take care of this by the end of the week.

Alright, finally had some time to sort through the logistics here. Everything is nearly ready to go, but if you could please let me know the units for all the...

Any mechanism is fine by me so long as it's consistent and I can parse it in some sort of systematic way. Putting it in brackets or parenthesis in the...

Ah, in-flight WiFi... you never know what you're going to get!

Also, just to note --- if you're busy, even just a plaintext file listing the units for each property is fine with me for now.

Beautiful. This is all virtually ready to go then. I just need to chat with the MPContribs maintainer to fix a bug preventing me from uploading >50 properties per material,...

Can you do me a small favor? When you upload the data to Zenodo, could you rename `qmof_data.csv` to something slightly more descriptive, such as `qmof_gcmc.csv` or `qmof_jablonka.csv`? That just...