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The Atom Interface and AtomImpl class in org.biojava.nbio.structure does not handle or store the charge on the atom from the PDB line. The PDBParser also needs to be modified to store and write this …
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# Description
# Corrections Required
Simple array math:
- gain (flat field)
- dark current
- normalize by beam intensity
Masking:
- Saturated pixels
- Dead pixels
- beam stop
- beam stop holder
- de…
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We have X-ray fiber diffraction on similar note need Neutron fiber diffraction.
Definition:
Analysis of diffraction pattern of a partially ordered sample composed of fibers oriented parallel to each o…
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- Component skeleton, for using as a basic building block but also for making easy future enhancements or additions from non developers
- Define a naming convention for the elements of the interface?
…
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When using `Geometry::CrystalStructure` with trigonal or hexagonal space groups, or rhombohedral centering, there can be problems with scattering factor calculation, because of the way `Group::operato…
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Ønsker `Røntgendiffraksjon`, `Lavtemperatur røntgendiffraksjon`, `X-ray diffraction` og `Xrd` sydd sammen i ett begrep:
```
Røntgendiffraksjon
BF Lavtemperatur røntgendiffraksjon
EN X-ray diffraction…
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Would it be possible to give the units, where applicable, for the function variables on the API page? For example I was rather confused about whether to use q in inverse Angstroms or inverse nm for t…
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**Original reporter**: _[FreddieAkeroyd](https://github.com/FreddieAkeroyd)_
Various instruments definitions are on the WIKI at http://www.nexusformat.org/Instruments but not in Subversion.
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Experimental techniques are stored as strings at the moment. I think this deserves a better representation, I'd propose an enum like this (it would go in my next pull request):
```
public enum ExpTec…