aboutsummaryrefslogtreecommitdiff
path: root/DESCRIPTION
diff options
context:
space:
mode:
authorJohannes Ranke <jranke@uni-bremen.de>2016-12-05 16:00:39 +0100
committerJohannes Ranke <jranke@uni-bremen.de>2016-12-05 18:29:42 +0100
commit762114a5ea6393cc73a09616b937397349c1a259 (patch)
tree788a32aa4e83022074876d831e8e9d5ad7c3ab5e /DESCRIPTION
parent363046c178398593dea33712ba281fb5556541a6 (diff)
Use new rdkit drawing code
This is SVG only, therefore use grConvert to convert to postscript before importing using grImport. SVG size is currently hardcoded.
Diffstat (limited to 'DESCRIPTION')
-rw-r--r--DESCRIPTION13
1 files changed, 7 insertions, 6 deletions
diff --git a/DESCRIPTION b/DESCRIPTION
index c50c9b4..a753034 100644
--- a/DESCRIPTION
+++ b/DESCRIPTION
@@ -2,18 +2,19 @@ Package: chents
Type: Package
Title: Chemical Entities as R Objects
Version: 0.2-5
-Date: 2016-10-14
+Date: 2016-12-05
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. 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.
+ data as R objects. If Python and RDKit (> 2015.03) 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,
+ grConvert,
yaml
Suggests:
knitr,
@@ -25,4 +26,4 @@ LazyData: yes
Encoding: UTF-8
VignetteBuilder: knitr
URL: http://cgit.jrwb.de/chents
-RoxygenNote: 5.0.1
+RoxygenNote: 5.0.1.9000

Contact - Imprint