Re: [phenixbb] Phenix crashes
Nat, 1.4-160 works just fine. Thank you. Katya Ekaterina Heldwein, Ph.D. Assistant Professor Department of Molecular Biology and Microbiology Tufts University School of Medicine 136 Harrison Ave Boston, MA 02111 phone: 617-636-0858 fax: 617-636-0337 e-mail: [email protected] [email protected] wrote:
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Today's Topics:
1. Phenix crashes (Katya Heldwein) 2. Re: Phenix crashes ([email protected]) 3. Re: Phenix crashes (Nathaniel Echols) 4. Re: Phenix crashes (Nathaniel Echols) 5. specifying column labels for input MTZ file (Tirumala Kumar Chowdary) 6. Re: specifying column labels for input MTZ file (Schubert, Carsten [PRDUS]) 7. Re: specifying column labels for input MTZ file (Pavel Afonine)
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Message: 1 Date: Wed, 09 Sep 2009 12:02:36 -0400 From: Katya Heldwein
Subject: [phenixbb] Phenix crashes To: [email protected] Message-ID: <[email protected]> Content-Type: text/plain; charset=ISO-8859-1; format="flowed" Hi,
I am running phenix-1.4-159 on an Intel Mac. I get the following error:
Bus error (Python call stack above) This crash may be due to a problem in any imported Python module, including modules which are not part of the cctbx project. To disable the traps leading to this message, define these environment variables (e.g. assign the value 1): BOOST_ADAPTBX_FPE_DEFAULT BOOST_ADAPTBX_SIGNALS_DEFAULT This will NOT solve the problem, just mask it, but may allow you to proceed in case it is not critical.
If I fix it by
setenv BOOST_ADAPTBX_FPE_DEFAULT 1
I still get the same error.
If I also do
setenv BOOST_ADAPTBX_SIGNALS_DEFAULT 1
I don't get the error but phenix crashes nonetheless.
How do I get around this problem?
Thanks,
Katya
------------------------------
Message: 2 Date: Wed, 9 Sep 2009 12:17:36 -0400 (EDT) From: [email protected] Subject: Re: [phenixbb] Phenix crashes To: "PHENIX user mailing list"
Message-ID: <[email protected]> Content-Type: text/plain;charset=iso-8859-1 Hi, This looks like a version problem, try installing the latest nightly builds. Shya
Hi,
I am running phenix-1.4-159 on an Intel Mac. I get the following error:
Bus error (Python call stack above) This crash may be due to a problem in any imported Python module, including modules which are not part of the cctbx project. To disable the traps leading to this message, define these environment variables (e.g. assign the value 1): BOOST_ADAPTBX_FPE_DEFAULT BOOST_ADAPTBX_SIGNALS_DEFAULT This will NOT solve the problem, just mask it, but may allow you to proceed in case it is not critical.
If I fix it by
setenv BOOST_ADAPTBX_FPE_DEFAULT 1
I still get the same error.
If I also do
setenv BOOST_ADAPTBX_SIGNALS_DEFAULT 1
I don't get the error but phenix crashes nonetheless.
How do I get around this problem?
Thanks,
Katya
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------------------------------
Message: 3 Date: Wed, 9 Sep 2009 09:37:50 -0700 From: Nathaniel Echols
Subject: Re: [phenixbb] Phenix crashes To: PHENIX user mailing list Message-ID: <[email protected]> Content-Type: text/plain; charset=US-ASCII; format=flowed; delsp=yes On Sep 9, 2009, at 9:02 AM, Katya Heldwein wrote:
I am running phenix-1.4-159 on an Intel Mac. I get the following error: Bus error (Python call stack above)
If I fix it by setenv BOOST_ADAPTBX_FPE_DEFAULT 1 I still get the same error. If I also do
setenv BOOST_ADAPTBX_SIGNALS_DEFAULT 1
I don't get the error but phenix crashes nonetheless.
How do I get around this problem?
Which programs are you running, and did you see a stack trace before the error message? I just noticed the same thing running phenix.refine from the same installer on my Mac, so it is probably an undiagnosed bug.
------------------- Nathaniel Echols Lawrence Berkeley Lab 510-486-5136 [email protected]
------------------------------
Message: 4 Date: Wed, 9 Sep 2009 09:46:24 -0700 From: Nathaniel Echols
Subject: Re: [phenixbb] Phenix crashes To: PHENIX user mailing list Message-ID: <[email protected]> Content-Type: text/plain; charset=US-ASCII; format=flowed; delsp=yes On Sep 9, 2009, at 9:17 AM, [email protected] wrote:
Hi, This looks like a version problem, try installing the latest nightly builds. Shya
Actually, 1.4-159 was the latest build until ten minutes ago, but I just checked 1.4-160 and it does not appear to have this problem, so it's now ready to download. Sorry for the trouble.
-Nat
------------------- Nathaniel Echols Lawrence Berkeley Lab 510-486-5136 [email protected]
------------------------------
Message: 5 Date: Wed, 09 Sep 2009 14:10:27 -0400 From: Tirumala Kumar Chowdary
Subject: [phenixbb] specifying column labels for input MTZ file To: [email protected] Message-ID: <[email protected]> Content-Type: text/plain; charset=ISO-8859-1; format="flowed" Hi,
I am trying to run phenix.refine with a sharp output MTZ file (column labels H K L NUMORB FB PHIB FOM HX HY FH PHIH FP SIGFP HLA HLB HLC HLD HL0 Fcent PHIcent FOMcent Fmap PHImap FHref PHIHref Fav SIGFav).
Phenix.refine stopped at
'Multiple equally suitable arrays of observed xray data found.
Possible choices: sharp_sad_se_eden.mtz:FP,SIGFP sharp_sad_se_eden.mtz:Fav,SIGFav
Please use refinement.input.xray_data.labels'
Can someone tell me on how to use this 'refinement.input.xray_data.labels' and how to specify which column labels to use. There is nothing written in the documentation about it.
Thanks Tirumal
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Message: 6 Date: Wed, 9 Sep 2009 14:22:40 -0400 From: "Schubert, Carsten [PRDUS]"
Subject: Re: [phenixbb] specifying column labels for input MTZ file To: "PHENIX user mailing list" Message-ID: <[email protected]> Content-Type: text/plain; charset="us-ascii" Tirumal:
refinement.input.xray_data.labels="FP,SIGFP"
should do the trick.
Cheers,
Carsten
-----Original Message----- From: [email protected] [mailto:phenixbb- [email protected]] On Behalf Of Tirumala Kumar Chowdary Sent: Wednesday, September 09, 2009 2:10 PM To: [email protected] Subject: [phenixbb] specifying column labels for input MTZ file
Hi,
I am trying to run phenix.refine with a sharp output MTZ file (column labels H K L NUMORB FB PHIB FOM HX HY FH PHIH FP SIGFP HLA HLB HLC
HLD
HL0 Fcent PHIcent FOMcent Fmap PHImap FHref PHIHref Fav SIGFav).
Phenix.refine stopped at
'Multiple equally suitable arrays of observed xray data found.
Possible choices: sharp_sad_se_eden.mtz:FP,SIGFP sharp_sad_se_eden.mtz:Fav,SIGFav
Please use refinement.input.xray_data.labels'
Can someone tell me on how to use this 'refinement.input.xray_data.labels' and how to specify which column labels to use. There is nothing written in the documentation about it.
Thanks Tirumal
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------------------------------
Message: 7 Date: Wed, 09 Sep 2009 11:24:46 -0700 From: Pavel Afonine
Subject: Re: [phenixbb] specifying column labels for input MTZ file To: PHENIX user mailing list Cc: [email protected] Message-ID: <[email protected]> Content-Type: text/plain; charset=ISO-8859-1; format=flowed Hi Tirumala,
I agree, you are not the first who confused by this and an example right in the message would help.
First, your MTZ file contains the following data: (FP,SIGFP) and (Fav,SIGFav) and it is your choice to select the one that you want to use in refinement.
Second, once decided on the data - for example it is FP, then just add to your command line this:
refinement.input.xray_data.labels=FP
or, which is the same
xray_data.labels="FP,SIGFP"
Pavel.
On 9/9/09 11:10 AM, Tirumala Kumar Chowdary wrote:
Hi,
I am trying to run phenix.refine with a sharp output MTZ file (column labels H K L NUMORB FB PHIB FOM HX HY FH PHIH FP SIGFP HLA HLB HLC HLD HL0 Fcent PHIcent FOMcent Fmap PHImap FHref PHIHref Fav SIGFav).
Phenix.refine stopped at
'Multiple equally suitable arrays of observed xray data found.
Possible choices: sharp_sad_se_eden.mtz:FP,SIGFP sharp_sad_se_eden.mtz:Fav,SIGFav
Please use refinement.input.xray_data.labels'
Can someone tell me on how to use this 'refinement.input.xray_data.labels' and how to specify which column labels to use. There is nothing written in the documentation about it.
Thanks Tirumal
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------------------------------
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End of phenixbb Digest, Vol 46, Issue 14 ****************************************
Hi all I am trying to use phenix.automr to search for two component. Tried command line... phenix.automr data=out.sca ensemble_1.coords=a1.pdb \ ensemble_1.RMS=0.65 ensemble_1_copies_to_find=5 componenet_1_mass=25000 \ component_1.component_copies=5 ensemble_2.coords=a2.pdb \ ensemble_2.RMS=0.60 ensemble_2.copies_to_find=5 componenet_2_mass=20000 \ component_2.component_copies=5 Following errors phenix-installer-1.4-147/phenix-1.4-147/phenix/phenix/command_line/automr.py", line 483, in <module> run_automr=run_automr(args=sys.argv[1:]) phenix-installer-1.4-147/phenix-1.4-147/phenix/phenix/autosol/wizard_command_line.py", line 1237, in Sorry raise AssertionError,e AssertionError: Sorry, unknown file or keyword: ensemble_1.coords=a1.pdb Not sure , What is wrong in my command? Also try to use the Gui, but in automr gui only seen option for data file , not for model? May I am missing something? Thanks
Did you cut and paste the command or retype it? If that's the exact command, I don't know what would be wrong with the bit "ensemble_1.coords=a1.pdb", but "ensemble_1_copies_to_find" should be "ensemble_1.copies_to_find" and "componenet" should be "component" and "_mass" should be ".mass". So I wonder if the parser got confused by the other syntax errors? Regards, Randy Read On 10 Sep 2009, at 17:28, r n wrote:
Hi all
I am trying to use phenix.automr to search for two component.
Tried command line...
phenix.automr data=out.sca ensemble_1.coords=a1.pdb \ ensemble_1.RMS=0.65 ensemble_1_copies_to_find=5 componenet_1_mass=25000 \ component_1.component_copies=5 ensemble_2.coords=a2.pdb \ ensemble_2.RMS=0.60 ensemble_2.copies_to_find=5 componenet_2_mass=20000 \ component_2.component_copies=5
Following errors
phenix-installer-1.4-147/phenix-1.4-147/phenix/phenix/command_line/ automr.py", line 483, in <module> run_automr=run_automr(args=sys.argv[1:]) phenix-installer-1.4-147/phenix-1.4-147/phenix/phenix/autosol/ wizard_command_line.py", line 1237, in Sorry raise AssertionError,e AssertionError: Sorry, unknown file or keyword: ensemble_1.coords=a1.pdb
Not sure , What is wrong in my command?
Also try to use the Gui, but in automr gui only seen option for data file , not for model? May I am missing something?
Thanks
_______________________________________________ phenixbb mailing list [email protected] http://www.phenix-online.org/mailman/listinfo/phenixbb
------ Randy J. Read Department of Haematology, University of Cambridge Cambridge Institute for Medical Research Tel: + 44 1223 336500 Wellcome Trust/MRC Building Fax: + 44 1223 336827 Hills Road E-mail: [email protected] Cambridge CB2 0XY, U.K. www- structmed.cimr.cam.ac.uk
The parameters changed at some point this year, but the main documentation link is still for 1.4-3. We now have the nightly build documentation linked from the download page, e.g.: http://www.phenix-online.org/documentation/nightlies/1.4-147/automr.htm I suspect in this case it will be necessary to write a parameter file rather than use the command line. Fortunately, there is a very good example of this in the documentation. On Sep 10, 2009, at 9:44 AM, Randy Read wrote:
Did you cut and paste the command or retype it? If that's the exact command, I don't know what would be wrong with the bit "ensemble_1.coords=a1.pdb", but "ensemble_1_copies_to_find" should be "ensemble_1.copies_to_find" and "componenet" should be "component" and "_mass" should be ".mass". So I wonder if the parser got confused by the other syntax errors?
Regards,
Randy Read
On 10 Sep 2009, at 17:28, r n wrote:
Hi all
I am trying to use phenix.automr to search for two component.
Tried command line...
phenix.automr data=out.sca ensemble_1.coords=a1.pdb \ ensemble_1.RMS=0.65 ensemble_1_copies_to_find=5 componenet_1_mass=25000 \ component_1.component_copies=5 ensemble_2.coords=a2.pdb \ ensemble_2.RMS=0.60 ensemble_2.copies_to_find=5 componenet_2_mass=20000 \ component_2.component_copies=5
Following errors
phenix-installer-1.4-147/phenix-1.4-147/phenix/phenix/command_line/ automr.py", line 483, in <module> run_automr=run_automr(args=sys.argv[1:]) phenix-installer-1.4-147/phenix-1.4-147/phenix/phenix/autosol/ wizard_command_line.py", line 1237, in Sorry raise AssertionError,e AssertionError: Sorry, unknown file or keyword: ensemble_1.coords=a1.pdb
Not sure , What is wrong in my command?
Also try to use the Gui, but in automr gui only seen option for data file , not for model? May I am missing something?
Thanks
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------ Randy J. Read Department of Haematology, University of Cambridge Cambridge Institute for Medical Research Tel: + 44 1223 336500 Wellcome Trust/MRC Building Fax: + 44 1223 336827 Hills Road E-mail: [email protected] Cambridge CB2 0XY, U.K. www- structmed.cimr.cam.ac.uk
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------------------- Nathaniel Echols Lawrence Berkeley Lab 510-486-5136 [email protected]
Thanks for everyone.
The link given by Nathaniel, works fine.
________________________________
From: Nathaniel Echols
Did you cut and paste the command or retype it? If that's the exact command, I don't know what would be wrong with the bit "ensemble_1.coords=a1.pdb", but "ensemble_1_copies_to_find" should be "ensemble_1.copies_to_find" and "componenet" should be "component" and "_mass" should be ".mass". So I wonder if the parser got confused by the other syntax errors?
Regards,
Randy Read
On 10 Sep 2009, at 17:28, r n wrote:
Hi all
I am trying to use phenix.automr to search for two component.
Tried command line...
phenix.automr data=out.sca ensemble_1.coords=a1.pdb \ ensemble_1.RMS=0.65 ensemble_1_copies_to_find=5 componenet_1_mass=25000 \ component_1.component_copies=5 ensemble_2.coords=a2.pdb \ ensemble_2.RMS=0.60 ensemble_2.copies_to_find=5 componenet_2_mass=20000 \ component_2.component_copies=5
Following errors
phenix-installer-1.4-147/phenix-1.4-147/phenix/phenix/command_line/ automr.py", line 483, in <module> run_automr=run_automr(args=sys.argv[1:]) phenix-installer-1.4-147/phenix-1.4-147/phenix/phenix/autosol/ wizard_command_line.py", line 1237, in Sorry raise AssertionError,e AssertionError: Sorry, unknown file or keyword: ensemble_1.coords=a1.pdb
Not sure , What is wrong in my command?
Also try to use the Gui, but in automr gui only seen option for data file , not for model? May I am missing something?
Thanks
_______________________________________________ phenixbb mailing list [email protected] http://www.phenix-online.org/mailman/listinfo/phenixbb
------ Randy J. Read Department of Haematology, University of Cambridge Cambridge Institute for Medical Research Tel: + 44 1223 336500 Wellcome Trust/MRC Building Fax: + 44 1223 336827 Hills Road E-mail: [email protected] Cambridge CB2 0XY, U.K. www- structmed.cimr.cam.ac.uk
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------------------- Nathaniel Echols Lawrence Berkeley Lab 510-486-5136 [email protected] _______________________________________________ phenixbb mailing list [email protected] http://www.phenix-online.org/mailman/listinfo/phenixbb
participants (4)
-
Katya Heldwein
-
Nathaniel Echols
-
r n
-
Randy Read