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<?xml version="1.0" encoding="UTF-8"?>
<!DOCTYPE pkgmetadata SYSTEM "https://www.gentoo.org/dtd/metadata.dtd">
<pkgmetadata>
  <herd>sci-chemistry</herd>
  <maintainer>
    <email>jlec@gentoo.org</email>
  </maintainer>
  <longdescription>
Numbat is a user friendly software that fits dX-tensor to a set of PCS 
measurements and a structure from a PDB file. It has also been designed to 
assist in the semi automatic process of PCS assignment. A detailed description 
of the software can be found in this publication: 

Christophe Schmitz, Mitchell J. Stanton-Cook, Xun-Cheng Su, Gottfried Otting, 
and Thomas Huber (2008). Numbat: an interactive software tool for fitting 
Δχ-tensors to molecular coordinates using pseudocontact shifts. Journal of 
Biomolecular NMR. 41:179-189.
</longdescription>
</pkgmetadata>