Last week I was using 13.2 and could reproduce the snap iconification on
delete item.
This morning I updated to 13.3 and the iconification problem is no more
- so the update fixed it. Apple didn't mention XQuartz or Coot in the
release notes (fwiw).
Paul.
Anyone who has ever had to lecture a student for writing their unit cell
lengths to dozens of decimal places is going to love the new PDB
format. It is more compact, more realistic, and less misleading to the
poor, downstream consumers of structural data.
Only a few structures in the PDB are
I have never met a computational chemist who did not "notice" when a
side chain is modeled as more than one conformer.
-James Holton
MAD Scientist
On 3/31/2023 8:31 AM, Olga Moroz wrote:
Hi everyone,
I always thought it is better to truncate so that biologists looking
at the structures are
Hi everyone,
I always thought it is better to truncate so that biologists looking at the
structures are not misled?
Not sure it the best aproach though...
Olga
> On 10 Mar 2023, at 02:45, Bernhard Lechtenberg
> <968307750321-dmarc-requ...@jiscmail.ac.uk> wrote:
>
> Hi Rhys,
>
> I am
The most pertinent question is, of course, what is the average frequency of
the disordered chain controversy flareup. Once we figure that out, some
profound mysteries of the Universe will reveal themselves. I am betting
it's a simple combination of the solar cycle, inflation adjusted price of a
On Tue, Mar 28, 2023, James Holton wrote:
Members of an ensemble spread out over a supercell are equivalent to a
conventional multi-conformer model, but only when it comes to the
density derived from the coordinate atoms alone. They are not the
same when it comes to bulk solvent and also
Dear colleagues,
We are organizing an Instruct-ERIC course in Oulu on X-ray, neutron and
electron crystallography. Please see the details in the web pages.
https://instruct-eric.org/events/instruct-eric-course-on-macromolecular-x-ray-electron-and-neutron-crystallography-2023/
The capillaries have already found a new owner !
Ulrike
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Dear all,
There is an opening for a PostDoc position in my group. Funding is generously
provided by an ERC Synergy Grant for the DynaPLIX project, wherein we aim to
understand the dynamics of protein ligand interaction via an integrative
approach combining NMR-spectroscopy (Mikael Akke, Lund
