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Hello,
I'm interested in integrating the `libtbx.easy_mp` module into a code I'm writing to parallel on an SGE cluster. I'm attempting to install the entire project (`python boostrap.py`) but I get…
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loads of tests still failing on python 3. This one is run by azure:
https://dev.azure.com/cctbx/cctbx_project/_build/results?buildId=184
`libtbx.python smtbx/refinement/restraints/tests/tst_restra…
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Ran, worked fine, failed at the end
```
Scaled reflections (WAVE1): /dls/i04/data/2020/mx27124-1/processing/gw56/SeThau-mad-both/xia2-dials/DataFiles/AUTOMATIC_DEFAULT_scaled_unmerged_WAVE1.mtz
S…
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Our code for reading NeXus files looks at incident_wavelength and if it's array, assumes that each value corresponds to a different image:
https://github.com/dials/dxtbx/blob/master/format/nexus.py#L…
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And has been since [at least March 2019](https://github.com/dials/cctbx/commit/d0701c3608db4313ebbcc37597d2a3324aaec60c).
As the test is skipped unless CCP4 is present we only notice its failure du…
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I have a case where every image fails to process in a `dials.ssx_integrate` run. In such a case, the program writes out a zero length reflection list:
```
Saving 0 reflections to integrated_1.refl
…
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Change the reading of maps from qFit infrastructure to CCTBX.
The two main functions to be converted are:
fromfile()
canonical_unit_cell()
This will include storing information about the space…
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`dxtbx.install_format -u` does not work on a Windows user installation, because it relies on creating the package name `dxtbx_custom` as a symlink to `%USERPROFILE%\.dxtbx`. On Windows without develop…
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Hello,
I work for a govt-funded project and as a contract requirement must install this software.
Back in 2014 when I last installed it on Ubuntu, the install threw the same error "No module na…
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Pointed out by @dagewa the other day, in `FormatCBFFullPilatus.py` we explicitly override the beam polarisation to synchotron values:
https://github.com/cctbx/cctbx_project/blob/c8767224cd85600d3cc6c…