| <?xml version="1.0" encoding="UTF-8"?> |
| <!DOCTYPE pkgmetadata SYSTEM "http://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> |
