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chents
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Chemical entities as R objects (also on github)
Johannes Ranke
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2021-11-18
Another attempt to get python3-rdkit on Travis
Johannes Ranke
1
-0
/
+2
2021-11-18
Install python3-rdkit on Travis
Johannes Ranke
1
-0
/
+4
2021-11-18
Use reticulate instead of PythonInR, alanwood has moved
Johannes Ranke
7
-84
/
+118
2020-10-13
Adapt to changes in webchem
Johannes Ranke
6
-26
/
+22
2020-10-13
Temporarily remove @example tags
Johannes Ranke
10
-58
/
+415
2019-07-15
Add chent$emf() function based on devEMF
Johannes Ranke
3
-3
/
+25
2019-03-20
Use shQuote for filename creation in chent$pdf()
Johannes Ranke
3
-3
/
+18
2019-02-21
Use codecov and update docs
Johannes Ranke
5
-2
/
+9
2019-02-19
Use rsvg instead of grConvert
Johannes Ranke
14
-36
/
+33
2019-02-19
Fix example
Johannes Ranke
4
-4
/
+18
2019-02-19
Only plot when a Picture object is there
Johannes Ranke
10
-41
/
+302
2019-02-19
Skip plotting in examples if grConvert is missing
Johannes Ranke
7
-22
/
+37
2019-02-19
Fix check for rdkit availability
Johannes Ranke
6
-80
/
+116
2019-02-19
Change package URL to github to get source code links
Johannes Ranke
21
-353
/
+880
2019-02-19
Add python-rdkit to travis configuration
Johannes Ranke
1
-0
/
+2
2019-02-19
Start using travis and update a test
Johannes Ranke
6
-8
/
+22
2018-09-27
Soil names for soil sorption tables
Johannes Ranke
3
-3
/
+11
2018-06-29
More details for soil degradation
Johannes Ranke
3
-1
/
+12
2018-06-22
Add country field to soil degradation data
Johannes Ranke
3
-2
/
+9
2018-05-20
Change pH_type to pH_medium
Johannes Ranke
3
-5
/
+11
2018-05-18
Revisited soil degradation and sorption
Johannes Ranke
4
-25
/
+91
2018-05-16
Vapour pressure and water solubility, use remark
Johannes Ranke
4
-11
/
+40
2018-03-01
Rebuild static documentation with current pkdown
Johannes Ranke
16
-182
/
+550
2017-06-13
Make grConvert optional as it vanished on Windows
Johannes Ranke
3
-21
/
+31
2017-03-17
Support a common template for depictions
Johannes Ranke
3
-35
/
+49
2017-03-15
Rerun pkgdown
Johannes Ranke
2
-1
/
+37
2017-03-15
Some minor cosmetics and pkgdown update
Johannes Ranke
3
-5
/
+5
2017-03-06
Correct link to the reference on pkgdown.jrwb.de
Johannes Ranke
3
-3
/
+3
2017-03-06
Type on README
Johannes Ranke
3
-3
/
+3
2017-03-06
Delete leftovers from staticdocs, rerun pkgdown
Johannes Ranke
20
-8638
/
+0
2017-03-06
Update pkgdown
Johannes Ranke
2
-2
/
+2
2017-03-06
Some updates
Johannes Ranke
5
-5
/
+17
2017-03-06
Switch to pkgdown and link to pkgdown.jrwb.de
Johannes Ranke
21
-92
/
+1357
2016-12-19
Make the pdf structures larger, update docs
Johannes Ranke
11
-11
/
+23
2016-12-05
Use new rdkit drawing code
Johannes Ranke
3
-11
/
+28
2016-10-15
Meta infos for pdf and self$Picture, png function
Johannes Ranke
4
-6
/
+53
2016-10-14
Merge branch 'master' of ssh://jrwb.de/chents
Johannes Ranke
1
-5
/
+14
2016-10-14
Better handling of ambiguous names and "source"s
Johannes Ranke
6
-49
/
+105
2016-10-13
chents for windows!
Johannes Ranke
2
-5
/
+26
2016-10-13
Remove unmaintained usage
Johannes Ranke
1
-10
/
+0
2016-10-13
Commit changelog as test for mirroring on github
Johannes Ranke
1
-0
/
+6
2016-10-13
Fix retrieving pubchem infos for ambiguous names
Johannes Ranke
6
-13
/
+26
2016-10-13
Do not fail if PythonInR is not installed
Johannes Ranke
1
-1
/
+1
2016-10-08
Add a method to write cropped pdf files
Johannes Ranke
3
-1
/
+51
2016-09-28
Add drat target
Johannes Ranke
1
-0
/
+3
2016-09-27
Update .Rbuildignore
Johannes Ranke
1
-4
/
+3
2016-09-27
Make the new README
Johannes Ranke
2
-6
/
+9
2016-09-27
Remove header with metadata, misrendered on github
Johannes Ranke
1
-1
/
+1
2016-09-27
Merge branch 'master' of github.com:jranke/chents
Johannes Ranke
0
-0
/
+0
2016-09-27
Remove mathjax from README
Johannes Ranke
5
-26
/
+104
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