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authorGlenn Johnson <glenn-johnson@uiowa.edu>2021-01-15 03:46:17 -0600
committerGitHub <noreply@github.com>2021-01-15 10:46:17 +0100
commit8f7b50b01f53c1519d5555b238c03fb45f8a8b17 (patch)
tree24557a5e4e51e60e24683c841f25e8d35eeae468
parent3d3761f8f0962c1b489dafda5d836954f1ccfbb8 (diff)
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add version 2.4-1 to r-bio3d (#20816)
-rw-r--r--var/spack/repos/builtin/packages/r-bio3d/package.py16
1 files changed, 15 insertions, 1 deletions
diff --git a/var/spack/repos/builtin/packages/r-bio3d/package.py b/var/spack/repos/builtin/packages/r-bio3d/package.py
index e366d005dd..e62bcd2733 100644
--- a/var/spack/repos/builtin/packages/r-bio3d/package.py
+++ b/var/spack/repos/builtin/packages/r-bio3d/package.py
@@ -7,12 +7,26 @@ from spack import *
class RBio3d(RPackage):
- """bio3d: Biological Structure Analysis"""
+ """Biological Structure Analysis
+
+ Utilities to process, organize and explore protein structure, sequence and
+ dynamics data. Features include the ability to read and write structure,
+ sequence and dynamic trajectory data, perform sequence and structure
+ database searches, data summaries, atom selection, alignment,
+ superposition, rigid core identification, clustering, torsion analysis,
+ distance matrix analysis, structure and sequence conservation analysis,
+ normal mode analysis, principal component analysis of heterogeneous
+ structure data, and correlation network analysis from normal mode and
+ molecular dynamics data. In addition, various utility functions are
+ provided to enable the statistical and graphical power of the R environment
+ to work with biological sequence and structural data. Please refer to the
+ URLs below for more information."""
homepage = "http://thegrantlab.org/bio3d/"
url = "https://cloud.r-project.org/src/contrib/bio3d_2.3-4.tar.gz"
list_url = "https://cloud.r-project.org/src/contrib/Archive/bio3d"
+ version('2.4-1', sha256='679fbd87fe9fb82a65427d281d3b68906509e411270cd87d2deb95d404333c1f')
version('2.3-4', sha256='f9b39ab242cbedafcd98c1732cb1f5c0dd9ef66e28be39695e3420dd93e2bafe')
depends_on('r@3.1.0:', type=('build', 'run'))