diff options
author | V3n3RiX <venerix@redcorelinux.org> | 2017-10-09 18:53:29 +0100 |
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committer | V3n3RiX <venerix@redcorelinux.org> | 2017-10-09 18:53:29 +0100 |
commit | 4f2d7949f03e1c198bc888f2d05f421d35c57e21 (patch) | |
tree | ba5f07bf3f9d22d82e54a462313f5d244036c768 /sci-chemistry/nmrglue/metadata.xml |
reinit the tree, so we can have metadata
Diffstat (limited to 'sci-chemistry/nmrglue/metadata.xml')
-rw-r--r-- | sci-chemistry/nmrglue/metadata.xml | 29 |
1 files changed, 29 insertions, 0 deletions
diff --git a/sci-chemistry/nmrglue/metadata.xml b/sci-chemistry/nmrglue/metadata.xml new file mode 100644 index 000000000000..55fa34fcbc44 --- /dev/null +++ b/sci-chemistry/nmrglue/metadata.xml @@ -0,0 +1,29 @@ +<?xml version="1.0" encoding="UTF-8"?> +<!DOCTYPE pkgmetadata SYSTEM "http://www.gentoo.org/dtd/metadata.dtd"> +<pkgmetadata> + <maintainer type="project"> + <email>sci-chemistry@gentoo.org</email> + <name>Gentoo Chemistry Project</name> + </maintainer> + <longdescription> +Nmrglue has the ability to read, write and convert between a number of NMR file +formats including Agilent/Varian, Bruker, NMRPipe, Sparky, SIMPSON, Rowland NMR +Toolkit files. The files, which are represented in Python as dictionaries of +spectral parameters and NumPy ndarray objects, can be easily examined, modified +and processed as desired. + +Nmrglue provides a number of functions for processing NMR data such as +apodization, spectral shifting, Fourier and other transformations, baseline +smoothing and flattening, and linear prediction modeling and extrapolation. +In addition new processing schemes can be implemented easily using the nmrglue +provided functions and the multitude of numerical routines provided by the NumPy +and SciPy packages. + +When used in conjunction with the matplotlib (or other) python plotting library +nmrglue can be used to create publication quality figures of NMR spectrum or +examine data interactively. +</longdescription> + <upstream> + <remote-id type="github">jjhelmus/nmrglue</remote-id> + </upstream> +</pkgmetadata> |