L PROTECTED]
> Cc: CCP4BB@jiscmail.ac.uk
> Subject: Re: [ccp4bb] pointless (1.2.0) and enantiomorphic SG's
>
> Eleanor Dodson wrote:
> > Offering a selection of space groups compatible with a
> point group will
> > not require reindexing.
> > Some poi
Eleanor Dodson wrote:
Offering a selection of space groups compatible with a point group will
not require reindexing.
Some point groups of course permit reindexing, but one hope you have
chosen a consistent set as you combine data sets into an MTZ file -
pointless and the GUI both offer ways to
Of course, you may need to re-index even if you have the right space
group...
Offering a selection of space groups compatible with a point group
will not require reindexing.
Some point groups of course permit reindexing, but one hope you have
chosen a consistent set as you combine data sets i
Offering a selection of space groups compatible with a point group will
not require reindexing.
Some point groups of course permit reindexing, but one hope you have
chosen a consistent set as you combine data sets into an MTZ file -
pointless and the GUI both offer ways to check this.
Phasing
etin board [mailto:[EMAIL PROTECTED] On Behalf Of
Kevin Cowtan
Sent: 09 November 2007 14:12
To: CCP4BB@JISCMAIL.AC.UK
Subject: Re: [ccp4bb] pointless (1.2.0) and enantiomorphic SG's
This is great! But before we all get carried away, a quick reality check
is in order. This isn't an are
-therapeutics.com
-Original Message-
From: CCP4 bulletin board [mailto:[EMAIL PROTECTED] On Behalf Of
Eleanor Dodson
Sent: 09 November 2007 13:51
To: CCP4BB@JISCMAIL.AC.UK
Subject: Re: [ccp4bb] pointless (1.2.0) and enantiomorphic SG's
As I often say!!! The mtz format should carry
This is great! But before we all get carried away, a quick reality check
is in order. This isn't an area I've thought about, but my limited
understanding raises the following issues
Given that an MTZ file contains a cell, an indexing of the data, and
possibly phases involving a choice of o
ed to go into the CCP4 MTZ library of course... And would
be a very valuable addition.
Cheers,
Graeme
-Original Message-
From: CCP4 bulletin board [mailto:[EMAIL PROTECTED] On Behalf Of
Phil Evans
Sent: 09 November 2007 13:54
To: CCP4BB@JISCMAIL.AC.UK
Subject: Re: [ccp4bb] poin
I agree too!
Martyn
On Fri, 2007-11-09 at 13:54 +, Phil Evans wrote:
> I agree
>
> On 9 Nov 2007, at 13:50, Eleanor Dodson wrote:
>
> > As I often say!!! The mtz format should carry point group and
> > alternate SGs - then be upgraded when youknow the correct SG..
> >
> > Eleanor
> >
> >
: Re: [ccp4bb] pointless (1.2.0) and enantiomorphic SG's
As I often say!!! The mtz format should carry point group and
alternate
SGs - then be upgraded when youknow the correct SG..
Eleanor
Phil Evans wrote:
It just picks the first in the list, to store in the output
MTZ file,
which can
I like it!
-- Ian
> -Original Message-
> From: [EMAIL PROTECTED]
> [mailto:[EMAIL PROTECTED] On Behalf Of Eleanor Dodson
> Sent: 09 November 2007 13:51
> To: Phil Evans
> Cc: CCP4BB@jiscmail.ac.uk
> Subject: Re: [ccp4bb] pointless (1.2.0) and enantiomorphic SG&
I agree
On 9 Nov 2007, at 13:50, Eleanor Dodson wrote:
As I often say!!! The mtz format should carry point group and
alternate SGs - then be upgraded when youknow the correct SG..
Eleanor
Phil Evans wrote:
It just picks the first in the list, to store in the output MTZ
file, which can onl
As I often say!!! The mtz format should carry point group and alternate
SGs - then be upgraded when youknow the correct SG..
Eleanor
Phil Evans wrote:
It just picks the first in the list, to store in the output MTZ file,
which can only handle one (92 < 96)
Phil
On 8 Nov 2007, at 22:26, Brya
It just picks the first in the list, to store in the output MTZ file,
which can only handle one (92 < 96)
Phil
On 8 Nov 2007, at 22:26, Bryan W. Lepore wrote:
when pointless (1.2.0) finds enantiomorphic SG's, what is the
criterion for 'Selecting' one over the other?
e.g. i ran pointless o
when pointless (1.2.0) finds enantiomorphic SG's, what is the criterion
for 'Selecting' one over the other?
e.g. i ran pointless on some tetragonal data, and the enantiomorphs
SG92/SG96 are selected as strong candidates
Spacegroup TotProb SysAbsProb Reindex Conditions
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