Jon Agirre

icon indicating a website link https://mastodon.world/web/@glycojones icon indicating an email [email protected]

icon company University of York icon location York, England icon location Royal Society University Research Fellow at York Structural Biology Laboratory (YSBL), University of York, UK. High-functioning propellerhead.

Results 2 issues of Jon Agirre

Stop flagging up high-energy conformations as 'check' in clear cases

A distorted monosaccharide with an RSCC > 0.90 is probably OK so shouldn't be flagged up as 'check'. Likewise, if RSCC < 0.5 then the user should be thinking twice...

enhancement

Flag up unnatural terminations

Find a way of representing unnatural terminations in the output mmCIF: EndoH, PNGase, or glycans with blurry arms.

enhancement