Re: [ccp4bb] Last few months updates, updated coot, ccp4i2, imosflm, etc

2018-07-09 Thread David Waterman
Dear Boaz, Jan,

Currently the base version 7.0.0 is installed and all updates are then
applied on top of this. This is very costly in terms of time and bandwidth.
To mitigate this, a new mechanism is being developed by CCP4. A checkpoint
version will be installed (something like minus 10 updates from the most
recent) and then the last few updates applied. This will help improve the
speed of installation, while still allowing a few updates to be rolled
back, if required. The final kinks are being ironed out from the new
installers at the moment, so these should be available fairly soon. There
will eventually be a new release of CCP4, resetting the update count to
zero, but that's a longer term plan.

Cheers
-- David


On Sat, 7 Jul 2018 at 19:12, Boaz Shaanan  wrote:

> Hi,
>
>
> For now, until there is a complete new version, I think that if you pick
> up the latest build from the ccp4 site it includes all the updates. I could
> be wrong though, but the CCP4 people will confirm this (or not).
>
>
> Cheers,
>
>
>   Boaz
>
>
>
>
>
>
>
>
>
>
>
>
> *Boaz Shaanan, Ph.D. Dept. of Life
> Sciences  Ben-Gurion University of the
> Negev  Beer-Sheva
> 84105
> Israel
> E-mail:
> bshaa...@bgu.ac.il  Phone: 972-8-647-2220
>Fax:   972-8-647-2992 or 972-8-646-1710*
>
>
>
>
>
>
>
> --
> *From:* CCP4 bulletin board  on behalf of Jan
> Stransky 
> *Sent:* Saturday, July 7, 2018 8:52 PM
> *To:* CCP4BB@JISCMAIL.AC.UK
> *Subject:* Re: [ccp4bb] Last few months updates, updated coot, ccp4i2,
> imosflm, etc
>
> Dear Charles,
> is there a plan to release new base package of CCP4 which would contain
> all updates, so we don't have to go through the already quite lengthy
> update process with new installations?
> Best regards,
> Jan
>
> On 07/05/2018 03:15 PM, Ballard, Charles (STFC,RAL,CSE) wrote:
> > For those of you not applying updates, the last few months updates have
> > included
> >
> > * phaser 2.8
> > * ccp4i2
> > * dials 1.9 (1.10 coming soon)
> > * ccp4mg
> > * coot 0.8.9.1
> >  * imosflm/ipmosfm 7.2.2
> >
> > plus interfaces to simbad, ample arcimboldo, and a dials gui DUI
> >
> > Update ID: 7.0.050
> > Date: 17.01.18
> >
> > Component  Description  Mac OS 64-bit   Linux 32-bitLinux
> 64-bitWindows
> > 32-bitWindows 64-bit
> > coot  0.8.9   yes yes yes -   -
> > aimless   0.6.2   yes yes yes yes yes
> >
> >
> > Update ID: 7.0.051
> > Date: 09.02.18
> >
> > Component  Description  Mac OS 64-bit   Linux 32-bitLinux
> 64-bitWindows
> > 32-bitWindows 64-bit
> > phaser2.8.2   yes yes yes yes yes
> > ccp4i updates for phaser 2.8  yes yes yes yes yes
> > arcimboldoupdates for phaser 2.8  yes yes yes yes yes
> > ample update to 1.4.1 yes yes yes yes yes
> > simbadupdate to 0.1.10yes yes yes -   -
> > dials update to 1.8.4 yes yes yes yes yes
> > ccp4i update for ampleyes yes yes yes yes
> >
> > Update ID: 7.0.052
> > Date: 28.02.18
> >
> > Component  Description  Mac OS 64-bit   Linux 32-bitLinux
> 64-bitWindows
> > 32-bitWindows 64-bit
> > ccp4i2Numerous bug fixes, improvments to stability, speed and
> > efficiencyyes yes yes yes yes
> >New: Arcimboldo yes yes yes -   -
> >New: Simbad yes yes yes -   -
> >New: Ample  yes yes yes yes yes
> >Enhancements to existing interfaces yes yes yes
> yes yes
> >New crystal definition and interface introduced yes yes
> yes yes yes
> >
> > Update ID: 7.0.053
> > Date: 19.03.18
> >
> > Component  Description  Mac OS 64-bit   Linux 32-bitLinux
> 64-bitWindows
> > 32-bitWindows 64-bit
> > ccp4mgfix issues with some refmac output  yes yes
> yes yes yes
> > pointless update to 1.11.10, read nXDS files  yes yes
> yes yes yes
> > buccaneer Bug fixes   yes yes yes yes yes
> > refmacBug fixes and speed enhancementsyes yes
> yes yes yes
> > crank2 

Re: [ccp4bb] Last few months updates, updated coot, ccp4i2, imosflm, etc

2018-07-07 Thread Boaz Shaanan




Hi,


For now, until there is a complete new version, I think that if you pick up the latest build from the ccp4 site it includes all the updates. I could be wrong though, but the CCP4 people will confirm this (or not).




Cheers,


  Boaz






 
 
Boaz Shaanan, Ph.D.

Dept. of Life Sciences  
Ben-Gurion University of the Negev  
Beer-Sheva 84105    
Israel  
    
E-mail: bshaa...@bgu.ac.il
Phone: 972-8-647-2220                    
Fax:   972-8-647-2992 or 972-8-646-1710
 
 












From: CCP4 bulletin board  on behalf of Jan Stransky 
Sent: Saturday, July 7, 2018 8:52 PM
To: CCP4BB@JISCMAIL.AC.UK
Subject: Re: [ccp4bb] Last few months updates, updated coot, ccp4i2, imosflm, etc
 



Dear Charles,
is there a plan to release new base package of CCP4 which would contain
all updates, so we don't have to go through the already quite lengthy
update process with new installations?
Best regards,
Jan

On 07/05/2018 03:15 PM, Ballard, Charles (STFC,RAL,CSE) wrote:
> For those of you not applying updates, the last few months updates have
> included
> 
> * phaser 2.8
> * ccp4i2 
> * dials 1.9 (1.10 coming soon)
> * ccp4mg
> * coot 0.8.9.1 
>  * imosflm/ipmosfm 7.2.2
> 
> plus interfaces to simbad, ample arcimboldo, and a dials gui DUI
> 
> Update ID: 7.0.050
> Date: 17.01.18
> 
> Component  Description  Mac OS 64-bit   Linux 32-bit    Linux 64-bit    Windows
> 32-bit    Windows 64-bit
> coot  0.8.9   yes yes yes -   -
> aimless   0.6.2   yes yes yes yes yes
> 
> 
> Update ID: 7.0.051
> Date: 09.02.18
> 
> Component  Description  Mac OS 64-bit   Linux 32-bit    Linux 64-bit    Windows
> 32-bit    Windows 64-bit
> phaser    2.8.2   yes yes yes yes yes
> ccp4i updates for phaser 2.8  yes yes yes yes yes
> arcimboldo    updates for phaser 2.8  yes yes yes yes yes
> ample update to 1.4.1 yes yes yes yes yes
> simbad    update to 0.1.10    yes yes yes -   -
> dials update to 1.8.4 yes yes yes yes yes
> ccp4i update for ample    yes yes yes yes yes
> 
> Update ID: 7.0.052
> Date: 28.02.18
> 
> Component  Description  Mac OS 64-bit   Linux 32-bit    Linux 64-bit    Windows
> 32-bit    Windows 64-bit
> ccp4i2    Numerous bug fixes, improvments to stability, speed and
> efficiency    yes yes yes yes yes
>    New: Arcimboldo yes yes yes -   -
>    New: Simbad yes yes yes -   -
>    New: Ample  yes yes yes yes yes
>    Enhancements to existing interfaces yes yes yes yes yes
>    New crystal definition and interface introduced yes yes yes yes yes
> 
> Update ID: 7.0.053
> Date: 19.03.18
> 
> Component  Description  Mac OS 64-bit   Linux 32-bit    Linux 64-bit    Windows
> 32-bit    Windows 64-bit
> ccp4mg    fix issues with some refmac output  yes yes yes yes yes
> pointless update to 1.11.10, read nXDS files  yes yes yes yes yes
> buccaneer Bug fixes   yes yes yes yes yes
> refmac    Bug fixes and speed enhancements    yes yes yes yes yes
> crank2    Bug fixes and enhancements  yes yes yes yes yes
> arcimboldo    Bug fixes   yes yes yes yes yes
> molrep    Bug fies    yes yes yes yes yes
> fragon    0.1.0, MR pipeline  yes yes yes -   -
> acedrg    New features and bug fixes  yes yes yes yes yes
> rabdam    radition damage detection, command line only    yes yes yes yes yes
> clipper   bug fix in mtz writing routine  yes yes yes yes yes
> morda database update 21  yes yes yes yes yes
> 
> Update ID: 7.0.054
> Date: 29.03.18
> 
> Component  Description  Mac OS 64-bit   Linux 32-bit    Linux 64-bit    Windows
> 32-bit    Windows 64-bit
> shelxe    bug fixes   yes yes yes yes yes
>    correction to shelxe NCS code   yes yes yes yes yes
> monomers  additional ligands  yes yes yes yes yes
> simbad    lattice and contaminant search  -   -   -   yes yes
> ccp4i2    new auspex interface    yes yes yes yes y

Re: [ccp4bb] Last few months updates, updated coot, ccp4i2, imosflm, etc

2018-07-07 Thread Jan Stransky
Dear Charles,
is there a plan to release new base package of CCP4 which would contain
all updates, so we don't have to go through the already quite lengthy
update process with new installations?
Best regards,
Jan

On 07/05/2018 03:15 PM, Ballard, Charles (STFC,RAL,CSE) wrote:
> For those of you not applying updates, the last few months updates have
> included
> 
> * phaser 2.8
> * ccp4i2 
> * dials 1.9 (1.10 coming soon)
> * ccp4mg
> * coot 0.8.9.1 
>  * imosflm/ipmosfm 7.2.2
> 
> plus interfaces to simbad, ample arcimboldo, and a dials gui DUI
> 
> Update ID: 7.0.050
> Date: 17.01.18
> 
> Component Description Mac OS 64-bit   Linux 32-bitLinux 64-bit
> Windows
> 32-bitWindows 64-bit
> coot  0.8.9   yes yes yes -   -
> aimless   0.6.2   yes yes yes yes yes
> 
> 
> Update ID: 7.0.051
> Date: 09.02.18
> 
> Component Description Mac OS 64-bit   Linux 32-bitLinux 64-bit
> Windows
> 32-bitWindows 64-bit
> phaser2.8.2   yes yes yes yes yes
> ccp4i updates for phaser 2.8  yes yes yes yes yes
> arcimboldoupdates for phaser 2.8  yes yes yes yes yes
> ample update to 1.4.1 yes yes yes yes yes
> simbadupdate to 0.1.10yes yes yes -   -
> dials update to 1.8.4 yes yes yes yes yes
> ccp4i update for ampleyes yes yes yes yes
> 
> Update ID: 7.0.052
> Date: 28.02.18
> 
> Component Description Mac OS 64-bit   Linux 32-bitLinux 64-bit
> Windows
> 32-bitWindows 64-bit
> ccp4i2Numerous bug fixes, improvments to stability, speed and
> efficiencyyes yes yes yes yes
>   New: Arcimboldo yes yes yes -   -
>   New: Simbad yes yes yes -   -
>   New: Ample  yes yes yes yes yes
>   Enhancements to existing interfaces yes yes yes yes 
> yes
>   New crystal definition and interface introduced yes yes yes 
> yes yes
> 
> Update ID: 7.0.053
> Date: 19.03.18
> 
> Component Description Mac OS 64-bit   Linux 32-bitLinux 64-bit
> Windows
> 32-bitWindows 64-bit
> ccp4mgfix issues with some refmac output  yes yes yes 
> yes yes
> pointless update to 1.11.10, read nXDS files  yes yes yes 
> yes yes
> buccaneer Bug fixes   yes yes yes yes yes
> refmacBug fixes and speed enhancementsyes yes yes 
> yes yes
> crank2Bug fixes and enhancements  yes yes yes yes 
> yes
> arcimboldoBug fixes   yes yes yes yes yes
> molrepBug fiesyes yes yes yes yes
> fragon0.1.0, MR pipeline  yes yes yes -   -
> acedrgNew features and bug fixes  yes yes yes yes 
> yes
> rabdamradition damage detection, command line onlyyes yes 
> yes yes yes
> clipper   bug fix in mtz writing routine  yes yes yes yes 
> yes
> morda database update 21  yes yes yes yes yes
> 
> Update ID: 7.0.054
> Date: 29.03.18
> 
> Component Description Mac OS 64-bit   Linux 32-bitLinux 64-bit
> Windows
> 32-bitWindows 64-bit
> shelxebug fixes   yes yes yes yes yes
>   correction to shelxe NCS code   yes yes yes yes yes
> monomers  additional ligands  yes yes yes yes yes
> simbadlattice and contaminant search  -   -   -   yes 
> yes
> ccp4i2new auspex interfaceyes yes yes yes yes
>   new simbad interface-   -   -   yes yes
>   updated refmac interfaceyes yes yes yes yes
>   updated lorestr interface   yes yes yes yes yes
>   updates arpwarp interface   yes yes yes -   -
> mosflmipmosflm 7.2.2  yes yes yes yes yes
>   imosflm 7.2.2   yes yes yes yes yes
> arcimboldoupdate for new shelxe   yes yes yes -   -
> refmacfixed output coordinates in mmcif file  yes yes yes 
> yes yes
> 
> Update ID: 7.0.055
> Date: 16.04.18
> 
> Component Description Mac OS 64-bit   Linux 32-bitLinux 64-bit
> Windows
> 32-bitWindows 64-bit
> coot  0.8.9.1 yes yes yes -   -
> xssp  3.0.0   yes yes yes yes yes
> rabdamBug fixes   yes yes yes yes yes
> srs   synchronise to monomer library  yes yes yes yes yes
> ccp4i2workaround for batch file launch issues -   -   -   
> yes yes
> 
> 
> Update ID: 7.0.056
> Date: 27.04.18
> 
> Component Description 

[ccp4bb] Last few months updates, updated coot, ccp4i2, imosflm, etc

2018-07-05 Thread Ballard, Charles (STFC,RAL,CSE)
For those of you not applying updates, the last few months updates have included

* phaser 2.8
* ccp4i2 
* dials 1.9 (1.10 coming soon)
* ccp4mg
* coot 0.8.9.1 
 * imosflm/ipmosfm 7.2.2

plus interfaces to simbad, ample arcimboldo, and a dials gui DUI
Update ID: 7.0.050
Date: 17.01.18

Component   Description Mac OS 64-bit   Linux 32-bitLinux 64-bit
Windows 32-bit  Windows 64-bit
coot0.8.9   yes yes yes -   -
aimless 0.6.2   yes yes yes yes yes

Update ID: 7.0.051
Date: 09.02.18

Component   Description Mac OS 64-bit   Linux 32-bitLinux 64-bit
Windows 32-bit  Windows 64-bit
phaser  2.8.2   yes yes yes yes yes
ccp4i   updates for phaser 2.8  yes yes yes yes yes
arcimboldo  updates for phaser 2.8  yes yes yes yes yes
ample   update to 1.4.1 yes yes yes yes yes
simbad  update to 0.1.10yes yes yes -   -
dials   update to 1.8.4 yes yes yes yes yes
ccp4i   update for ampleyes yes yes yes yes
Update ID: 7.0.052
Date: 28.02.18

Component   Description Mac OS 64-bit   Linux 32-bitLinux 64-bit
Windows 32-bit  Windows 64-bit
ccp4i2  Numerous bug fixes, improvments to stability, speed and efficiency  
yes yes yes yes yes
New: Arcimboldo yes yes yes -   -
New: Simbad yes yes yes -   -
New: Ample  yes yes yes yes yes
Enhancements to existing interfaces yes yes yes yes yes
New crystal definition and interface introduced yes yes yes yes 
yes
Update ID: 7.0.053
Date: 19.03.18

Component   Description Mac OS 64-bit   Linux 32-bitLinux 64-bit
Windows 32-bit  Windows 64-bit
ccp4mg  fix issues with some refmac output  yes yes yes yes 
yes
pointless   update to 1.11.10, read nXDS files  yes yes yes 
yes yes
buccaneer   Bug fixes   yes yes yes yes yes
refmac  Bug fixes and speed enhancementsyes yes yes yes 
yes
crank2  Bug fixes and enhancements  yes yes yes yes yes
arcimboldo  Bug fixes   yes yes yes yes yes
molrep  Bug fiesyes yes yes yes yes
fragon  0.1.0, MR pipeline  yes yes yes -   -
acedrg  New features and bug fixes  yes yes yes yes yes
rabdam  radition damage detection, command line onlyyes yes yes 
yes yes
clipper bug fix in mtz writing routine  yes yes yes yes yes
morda   database update 21  yes yes yes yes yes
Update ID: 7.0.054
Date: 29.03.18

Component   Description Mac OS 64-bit   Linux 32-bitLinux 64-bit
Windows 32-bit  Windows 64-bit
shelxe  bug fixes   yes yes yes yes yes
correction to shelxe NCS code   yes yes yes yes yes
monomersadditional ligands  yes yes yes yes yes
simbad  lattice and contaminant search  -   -   -   yes yes
ccp4i2  new auspex interfaceyes yes yes yes yes
new simbad interface-   -   -   yes yes
updated refmac interfaceyes yes yes yes yes
updated lorestr interface   yes yes yes yes yes
updates arpwarp interface   yes yes yes -   -
mosflm  ipmosflm 7.2.2  yes yes yes yes yes
imosflm 7.2.2   yes yes yes yes yes
arcimboldo  update for new shelxe   yes yes yes -   -
refmac  fixed output coordinates in mmcif file  yes yes yes yes 
yes
Update ID: 7.0.055
Date: 16.04.18

Component   Description Mac OS 64-bit   Linux 32-bitLinux 64-bit
Windows 32-bit  Windows 64-bit
coot0.8.9.1 yes yes yes -   -
xssp3.0.0   yes yes yes yes yes
rabdam  Bug fixes   yes yes yes yes yes
srs synchronise to monomer library  yes yes yes yes yes
ccp4i2  workaround for batch file launch issues -   -   -   yes 
yes

Update ID: 7.0.056
Date: 27.04.18

Component   Description Mac OS 64-bit   Linux 32-bitLinux 64-bit
Windows 32-bit  Windows 64-bit
monomerscorrections for ASN etc yes yes yes yes yes
dui New interface for DIALS yes yes yes yes yes
cctbx   Update to 2018 January  yes yes yes yes yes
phaser  Update to 2.8.2 yes yes yes yes yes
dials   Update to 1.9.2 yes yes yes yes yes
xia2Update to 0.5.542   yes yes yes yes yes
aimless Update to 0.7.1 yes yes yes yes yes
ccp4i   correction to phaser atom search interface  yes yes yes 
yes yes
imosflm correction to running of pointless and aimless  -