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Calculate magnetic and nuclear scattering structure factor.
- for neutron and X-ray
- simulate powder spectra
- simulate single crystal diffraction planes
- simulate Laue pattern
Basically copy f…
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As of now, there's only one, catch-all, term:
MI:0114 - X-ray crystallography
with description suggesting it applies to only one
particular technique - single crystal diffraction
whereas, in practic…
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As of now, there's only one, catch-all, term:
MI:0114 - X-ray crystallography
with description suggesting it applies to only one
particular technique - single crystal diffraction
whereas, in practic…
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As decided in issue #311, Sydney Grammar School Students are attempting to synthesise Daraprim at School. Background below is edited from issue #311
This molecule received a lot of press back in 201…
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The mitab parser will fail if the name of the organism contains parenthesis. This is the case for instance with strains of bacteria.
e.g. (from DIP mitab export): taxid:246196(Mycobacterium smegmati…
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# Description
2-D images frequently have many interesting features which are of scientific interest. In reciprocal space, these are frequently diffraction peaks (2-D [Voigt profile](http://en.wikipe…
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We need to add some more interaction Method choices (e.g. yeast 2-hybrid) for Experimental interactions. Also, choices for genetic interactions. Review these drop-down selections AND decide whether M…
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@bmooers, the README has a link to "Gassner et al. 2004" that I couldn't find in Google Scholar. I suggest including it --to help readers and to help SEO.
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```
[integrate] java.lang.NumberFormatException: For input string: "RIER"
[integrate] at java.lang.NumberFormatException.forInputString(NumberFormatException.java:65)
[integrate] at java.lang.…