[ccp4bb] Fill-your-own-model with AlphaFill and other updates

2022-11-28 Thread Robbie Joosten
Dear bulletin boarders,

The previous version of this post did not come through. Apologies if this turns 
out to be a double post.

To celebrate the publication of our AlphaFill paper 
(https://www.nature.com/articles/s41592-022-01685-y), we have released a new 
version of our https://alphafill.eu website. It has some (we hope) useful new 
features:
- AlphaFold V3 and V4 entries (all Uniprot entries) are now available. When you 
ask for them, the AlphaFold model is downloaded through the 3D-Beacons system 
and filled on-the-fly.
- You can download AlphaFill entries with your personal selection of 
transplants. The download button is above the transplant selection boxes.
- Fill-your-own-model is now available for any structure model (computational 
or experimental). Just upload a valid mmCIF or PDB file and it will look for 
potential ligands ions and cofactors. This feature is completely new and 
constructive feedback is always appreciated. 

All the best,
Maarten, Ida, Robbie and Tassos



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[ccp4bb] Fill-your-own-model with AlphaFill and other updates

2022-11-25 Thread Robbie Joosten
Dear bulletin boarders,

To celebrate the publication of our AlphaFill paper 
(https://www.nature.com/articles/s41592-022-01685-y), we have released a new 
version of our https://alphafill.eu website. It has some (we hope) useful new 
features:
- AlphaFold V3 and V4 entries (all Uniprot entries) are now available. When you 
ask for them, the AlphaFold model is downloaded through the 3D-Beacons system 
and filled on-the-fly.
- You can download AlphaFill entries with your personal selection of 
transplants. The download button is above the transplant selection boxes.
- Fill-your-own-model is now available for any structure model (computational 
or experimental). Just upload a valid mmCIF or PDB file and it will look for 
potential ligands ions and cofactors. This feature is completely new and 
constructive feedback is always appreciated. 

All the best,
Maarten, Ida, Robbie and Tassos




To unsubscribe from the CCP4BB list, click the following link:
https://www.jiscmail.ac.uk/cgi-bin/WA-JISC.exe?SUBED1=CCP4BB=1

This message was issued to members of www.jiscmail.ac.uk/CCP4BB, a mailing list 
hosted by www.jiscmail.ac.uk, terms & conditions are available at 
https://www.jiscmail.ac.uk/policyandsecurity/