Hello,
Follow up concerning my query to the bb (in case anyone is interested),
reply received from Robert Preissner through Philip E. Bourne and Joel
Sussman:
The Superimposé server was stopped in May 2018.
Fred. Vellieux
On 2/28/20 7:47 AM, Fred Vellieux wrote:
*Hello,
I am looking
Hi again,
First, I wish to thank everyone for their responses. I hope that no one minds
that I include them in my response letter to the Editor ?
The idea of citing the Karplus and Diedrichs paper in Science has been
essentially consumed already in our first response letter, which accompanied
Dear Dale,
your last sentence is of great importance:
"leaving the (hopefully) manually inspected and curated Hydrogen atoms in
the deposited PDB"
I believe this hope is unrealistic. Most people do probably not think or
understand what refinement programs do about hydrogen atoms. In Refmac5 it
Hi Dale,
You make very valid points and there are good reasons to keep the refined
hydrogen positions (methyl twists an protonation of HIS are good examples).
There is a way of distinguishing refined a modelled hydrogens in mmCIF and we
should start using that.
About protonation of hustidines:
Dear all,
Just a reminder of the Postoctoral positions currently open in our laboratory.
The positions are for 15 months initially, but extendable to up to 7 years!
Harry up applying shortlisting of candidates started already!
Best wishes,
Ale
PS. Get in touch with me directly if you require
