Hi Tom,
Thanks for the quick response!
To run this specific test:
$ libtbx.python $(libtbx.find_in_repositories iotbx/regression/tst_merging_statistics.py)
The test also uses the file phenix_regression/wizards/unmerged.mtz which I guess was also removed with the same commit?
$ grep phenix_regression $(libtbx.find_in_repositories iotbx/regression/tst_merging_statistics.py)
if (not libtbx.env.has_module("phenix_regression")) :
print "phenix_regression not configured, skipping."
relative_path="phenix_regression/wizards/p9_se_w2.sca",
relative_path="phenix_regression/harvesting/unmerged.sca",
relative_path="phenix_regression/harvesting/refine.mtz",
relative_path="phenix_regression/reflection_files/i_anomalous.mtz",
relative_path="phenix_regression/wizards/unmerged.mtz",
relative_path="phenix_regression/reflection_files/AUTOMATIC_DEFAULT_scaled_unmerged_WAVE1.mtz",
$ libtbx.find_in_repositories phenix_regression/wizards/unmerged.mtz
Sorry: libtbx.find_in_repositories: cannot locate "phenix_regression/wizards/unmerged.mtz"
The other files still seem to be present in phenix_regression.
Cheers,
Richard
Dr Richard Gildea
Data Analysis Scientist
Tel: +441235 77 8078
Diamond Light Source Ltd.
Diamond House
Harwell Science & Innovation Campus
Didcot
Oxfordshire
OX11 0DE
________________________________________
From: Terwilliger, Thomas Charles [[email protected]]
Sent: 06 January 2017 15:57
To: Gildea, Richard (DLSLtd,RAL,LSCI); [email protected]
Cc: Terwilliger, Thomas Charles
Subject: Re: iotbx.merging_statistics test failing: data file removed from phenix_regression
Hi Richard,
Thanks for pointing that out! I'll fix it. Yes, I deleted that file when I moved all the small files in phenix_regression/wizards/ into sub-directories. I made the mistake of assuming that only wizards/ regression tests used files in the wizards/ directory (I should have run all the cctbx regression tests to make sure).
All the best,
Tom T
________________________________________
From: [email protected]
Sent: Friday, January 6, 2017 8:51 AM
To: [email protected]; Terwilliger, Thomas Charles
Subject: iotbx.merging_statistics test failing: data file removed from phenix_regression
Hi all,
The test for iotbx.merging_statistics has recently started failing as a result of one of the files it uses for testing being deleted, phenix_regression/wizards/p9_se_w2.sca:
https://github.com/cctbx/cctbx_project/blob/master/iotbx/regression/tst_merg...
Would it be possible to restore this file to phenix_regression so that the test will pass?
$ svn log -r r3879 -v
------------------------------------------------------------------------
r3879 | terwill | 2016-12-29 02:48:15 +0000 (Thu, 29 Dec 2016) | 1 line
Changed paths:
D /trunk/wizards/000README
D /trunk/wizards/4c5q.pdb
D /trunk/wizards/ATP.pdb
D /trunk/wizards/MM-all.tgz
D /trunk/wizards/NAD.pdb
D /trunk/wizards/PARAMS_1.eff
D /trunk/wizards/a2u-data.mtz
D /trunk/wizards/a2u-sigmaa.mtz
D /trunk/wizards/a2u.sca
D /trunk/wizards/a2u_short.pdb
D /trunk/wizards/anb.pdb
D /trunk/wizards/autosol_unmerged_False.std
D /trunk/wizards/autosol_unmerged_True.std
D /trunk/wizards/autosol_unmerged_p9.std
D /trunk/wizards/bad_model.pdb
D /trunk/wizards/check.xyz
D /trunk/wizards/check_multiple_input_files_042908.tgz
D /trunk/wizards/check_multiple_input_files_062608.tgz
D /trunk/wizards/check_multiple_input_files_070508.tgz
D /trunk/wizards/check_multiple_input_files_2011-03-03.tgz
D /trunk/wizards/check_multiple_input_files_2011-06-29.tgz
D /trunk/wizards/check_multiple_input_files_2011-11-04.tgz
D /trunk/wizards/clean.com
D /trunk/wizards/cocn.cif
D /trunk/wizards/coords.pdb
D /trunk/wizards/coords1.ali
D /trunk/wizards/coords1.mtz
D /trunk/wizards/coords1.pdb
D /trunk/wizards/coords_A001.pdb
D /trunk/wizards/coords_rna.pdb
D /trunk/wizards/coords_rna_gap.pdb
D /trunk/wizards/data_for_commands_in_doc.tgz
D /trunk/wizards/find_all_ligands.eff
D /trunk/wizards/find_all_ligands.standard
D /trunk/wizards/find_ncs_ncs.standard
D /trunk/wizards/find_ncs_resolve.standard
D /trunk/wizards/fobs.mtz
D /trunk/wizards/fobs_std.mtz
D /trunk/wizards/fobs_std_edit.mtz
D /trunk/wizards/gene-5.pdb
D /trunk/wizards/generate.com
D /trunk/wizards/get_cc_mtz_mtz.standard
D /trunk/wizards/get_cc_mtz_pdb.standard
D /trunk/wizards/ha.pdb
D /trunk/wizards/ha_lig.pdb
D /trunk/wizards/ha_perfect.pdb
D /trunk/wizards/ha_perfect_2.pdb
D /trunk/wizards/hipip.pdb
D /trunk/wizards/hipip_2.sca
D /trunk/wizards/hipip_shortseq.dat
D /trunk/wizards/ignore.dat
D /trunk/wizards/inf.sca
D /trunk/wizards/ki.sca
D /trunk/wizards/ligand.pdb
D /trunk/wizards/mad.eff
D /trunk/wizards/mad.mtz
D /trunk/wizards/map_coeffs.mtz
D /trunk/wizards/map_coeffs_1.mtz
D /trunk/wizards/map_coeffs_2.mtz
D /trunk/wizards/map_to_object.standard
D /trunk/wizards/maps_only.standard
D /trunk/wizards/mir.eff
D /trunk/wizards/mlt.mtz
D /trunk/wizards/mlt_gap.pdb
D /trunk/wizards/mlt_regression.tgz
D /trunk/wizards/mol1.pdb
D /trunk/wizards/mol2.pdb
D /trunk/wizards/mr_rosetta.eff
D /trunk/wizards/mult_regr.tgz
D /trunk/wizards/multi.pdb
D /trunk/wizards/multi.pdb.mtz
D /trunk/wizards/my_autobuild.eff
D /trunk/wizards/my_automr.eff
D /trunk/wizards/my_autosol.eff
D /trunk/wizards/my_ligand.pdb
D /trunk/wizards/my_ligandfit.eff
D /trunk/wizards/my_target.pdb
D /trunk/wizards/native.sca
D /trunk/wizards/noligand.mtz
D /trunk/wizards/omit_lig_results.list
D /trunk/wizards/omit_regr.tgz
D /trunk/wizards/p.pdb
D /trunk/wizards/p21.sym
D /trunk/wizards/p9-seq.dat
D /trunk/wizards/p9-sites.xyz
D /trunk/wizards/p9_ha.pdb
D /trunk/wizards/p9_se_w2.sca
D /trunk/wizards/part_mlt.pdb
D /trunk/wizards/partial.pdb
D /trunk/wizards/partial_refine_001.pdb
D /trunk/wizards/partial_refine_001_map_coeffs.mtz
D /trunk/wizards/peak.sca
D /trunk/wizards/perfect.mtz
D /trunk/wizards/perfect_rna.mtz
D /trunk/wizards/phaser_1_offset.mtz
D /trunk/wizards/pt.sca
D /trunk/wizards/quick_clashlist.standard
D /trunk/wizards/random.pdb
D /trunk/wizards/random_0.7_mlt.mtz
D /trunk/wizards/resolve_1_offset.mtz
D /trunk/wizards/rna.seq
D /trunk/wizards/run_multi.eff
D /trunk/wizards/run_multi_new.eff
D /trunk/wizards/seq.dat
D /trunk/wizards/seq1.dat
D /trunk/wizards/seq2.dat
D /trunk/wizards/seq_mlt.dat
D /trunk/wizards/short_seq.standard
D /trunk/wizards/side.pdb
D /trunk/wizards/sir_sad.eff
D /trunk/wizards/sites_mlt.pdb
D /trunk/wizards/smiles.dat
D /trunk/wizards/solve.setup
D /trunk/wizards/start.pdb
D /trunk/wizards/starting_map.mtz
D /trunk/wizards/test3.gz
D /trunk/wizards/test9.gz
D /trunk/wizards/test_ampl_int_autobuild.tgz
D /trunk/wizards/test_labels_1.std
D /trunk/wizards/test_labels_2.std
D /trunk/wizards/test_labels_3.std
D /trunk/wizards/test_missing.std
D /trunk/wizards/test_multi.tgz
D /trunk/wizards/test_ncs.standard
D /trunk/wizards/test_ncs_find_ncs.standard
D /trunk/wizards/test_ncs_lc.pdb
D /trunk/wizards/test_resno.std
D /trunk/wizards/test_resno.tgz
D /trunk/wizards/unmerged.mtz
D /trunk/wizards/w1.sca
D /trunk/wizards/w1_rna.sca
D /trunk/wizards/w2.sca
remove unneeded files
------------------------------------------------------------------------
Cheers,
Richard
Dr Richard Gildea
Data Analysis Scientist
Tel: +441235 77 8078
Diamond Light Source Ltd.
Diamond House
Harwell Science & Innovation Campus
Didcot
Oxfordshire
OX11 0DE
--
This e-mail and any attachments may contain confidential, copyright and or privileged material, and are for the use of the intended addressee only. If you are not the intended addressee or an authorised recipient of the addressee please notify us of receipt by returning the e-mail and do not use, copy, retain, distribute or disclose the information in or attached to the e-mail.
Any opinions expressed within this e-mail are those of the individual and not necessarily of Diamond Light Source Ltd.
Diamond Light Source Ltd. cannot guarantee that this e-mail or any attachments are free from viruses and we cannot accept liability for any damage which you may sustain as a result of software viruses which may be transmitted in or with the message.
Diamond Light Source Limited (company no. 4375679). Registered in England and Wales with its registered office at Diamond House, Harwell Science and Innovation Campus, Didcot, Oxfordshire, OX11 0DE, United Kingdom