Interesting idea, Angel. But part of my purpose is to be able to create
crystal symmetry PDB files that can be handled by FirstGlance as it is.
It assumes that each chain has a different name and many of its tools
are coded under that assumption.
With all the other power in Jmol, it seems
Eric,
You could use variables that you assign and then select by those
e.g.
chainA = {chain=A and 1.1}
chainB = {chain=B and 1.1}
chainC = {chain=C and 1.1}
chainG = {chain=A and 2.1}
chainH = {chain=B and 2.1}
chainI = {chain=C and 2.1}
then
select chainG
Dear Bob,
Like Angel, I'm a little unsure what your reply means.
Is there no way to change the chain name assigned to specified atoms?
If not, I think it would be very useful.
-Eric
On 6/22/16 12:37 PM, Robert Hanson wrote:
Yes, sorry, that's a failure to throw an error. Fixed.
On Sun,
Thank you for your help, Rolf. I am not always sure what properties are
available, or even how they are named. The full output is useful.
Matt
From: Rolf Huehne [rolf.hue...@leibniz-fli.de]
Sent: Wednesday, June 22, 2016 3:30 PM
To:
On 06/22/2016 09:02 PM, Kubasik, Matthew A. wrote:
> Rolf,
>
> Sorry, I switched conventions, which is confusing everything.
>
> So, yes, "print {atomno=3}.a?" works to print atom properties with names
> beginning with "a", but I thought "print {atomno=3}.?" would give ALL atom
> properties.
>
Rolf,
Sorry, I switched conventions, which is confusing everything.
So, yes, "print {atomno=3}.a?" works to print atom properties with names
beginning with "a", but I thought "print {atomno=3}.?" would give ALL atom
properties.
Same as, "print @3.a?" works, but I thought "print @3.?"
On 06/22/2016 08:25 PM, Kubasik, Matthew A. wrote:
> Bob and List,
>
> Using the stand alone app on a Mac (10.11.5), I cannot seem to get the
> wildcard for atom properties to work as I would expect from
>
> http://chemapps.stolaf.edu/jmol/docs/index.htm?ver=14.6.0_2016.06.14#atomproperties.
>
>
Steve was actually looking at ones that were nominally mine. I know one was my
laptop and another was the desktop. I think we had some mac laptops at one
point that are gone. All of the ip’s he had for for Apple devices. We
decided to cancel them all and see who complains:-)
> On Jun
Bob and List,
Using the stand alone app on a Mac (10.11.5), I cannot seem to get the wildcard
for atom properties to work as I would expect from
http://chemapps.stolaf.edu/jmol/docs/index.htm?ver=14.6.0_2016.06.14#atomproperties.
The doc says print {atomno=3}.a? will give the atom properties
Yes, that helps. Broken in 14.5.5. Fixed in next release. (tonight)
On Fri, Jun 17, 2016 at 10:54 AM, Otis Rothenberger
wrote:
> Bob,
>
> If it helps, 14.4.4_2016.03.25 is a few days after you fixed the click
> invert and compare IS WORKING in this version.
>
> Otis
> --
>
Bob, do you mean it is a failure NOT to throw an error?
>From the doc I understand, as Eric said, that chain ID cannot be reassigned
El 22 Jun 2016 a las 12:37, Robert Hanson escribió:
> Yes, sorry, that's a failure to throw an error. Fixed.
>
> On Sun, Jun 19, 2016 at 8:43 PM, Eric Martz
Yes, sorry, that's a failure to throw an error. Fixed.
On Sun, Jun 19, 2016 at 8:43 PM, Eric Martz
wrote:
> How do I change the name of a chain from e.g. A to B?
>
> For example, I load chain A, then load append the same chain A, then
> translate selected 2.1.
>
>
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