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authorJohannes Ranke <jranke@uni-bremen.de>2015-09-28 21:34:23 +0200
committerJohannes Ranke <jranke@uni-bremen.de>2015-09-28 22:10:56 +0200
commitf908377f1de2e04ca3720d10084169c46a477ce2 (patch)
tree439bd00dec3a988f76ff74fd5ee652f55b17d061 /DESCRIPTION
parent1df33dbb3d310f94ccddbf57906e12bd6fa93c3f (diff)
Several changes heading for a release to the public
- Add tests - Add staticdocs - Documentation improvements - Several small code improvements
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Package: chents
Type: Package
Title: Chemical Entities as R Objects
-Version: 0.1-2
-Date: 2015-09-11
+Version: 0.2-1
+Date: 2015-09-28
Authors@R: c(person("Johannes", "Ranke", role = c("aut", "cre", "cph"),
email = "jranke@uni-bremen.de"))
Description: Utilities for dealing with chemical entities and associated data as R objects.
-Imports: webchem, R6
+ If Python and RDKit are installed and configured for use with 'PythonInR',
+ some basic chemoinformatics functions like the calculation of molecular weight
+ and plotting of chemical structures in R graphics are available.
+Imports: webchem, R6, grImport, PythonInR, yaml
Suggests: knitr, testthat
License: GPL
LazyLoad: yes

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