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After processing a year's worth of waveforms for 77 stations here in Australia, the code doesn't want to process the dispersion curves using dispersion_curves.py. The maximum I can get for this workin…
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On the CUDA platform I'm finding that the potential energy stored in a custom integrator global variable is not agreeing with the value obtained by probing the state object. Things work fine on the C…
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I'm wondering what the current thought regarding explicit solvent in yank 1.0 is...if it's going to wait, then I think the SystemBuilders should also wait, due to the GB issue. If it's not, then I'll …
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Python 2.7, astropy 1.0.1
Hi,
I am starting to work with images that have SIP distoorions in their WCS. My example image is from Spitzer and does contain the SIP keywords. When creating the WCS obj…
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```
Internal Server Error: /collections/YFWCSZGJ/edit
Traceback (most recent call last):
File "/opt/nv_env/local/lib/python2.7/site-packages/django/core/handlers/base.py", line 111, in get_response
…
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I'm still collecting information on this, but it appears my TIP3P water box where the softcore Lennard-Jones interactions of one water with all other waters are moved to a `CustomNonbondedForce` fails…
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or fallback to a preset base domain `neurovault.org` in settings
```
Internal Server Error: /collections/LVGIAVDD/edit
Traceback (most recent call last):
File "/opt/nv_env/local/lib/python2.7/site-…
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```
Please complete the following lines...
Application Version: FDS5.4.1
SVN Revision Number: 4708
Compile Date: 10 Sep 2009
Operating System: Linux
This issue is related to issue 864.
If you run t…
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I talked to @peastman about this a little, but figured it's appropriate for an issue here. The main problem is when we implement NBFIX functionality via a pairwise parameter look-up table (which is t…
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I have some Serialized XML files that were created with a recent Git version of OpenMM, but are showing errors in the potential energies when loaded into OpenMM 5.1 This is important for FAH, where w…