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Chemical entities as R objects (also on github)
Johannes Ranke
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DESCRIPTION
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2024-06-20
Use first 27 chars from InChIKey if BCPC returns more
Ranke Johannes
1
-2
/
+2
2024-06-20
Fix rdkit availability, prefer user/isomeric SMILES
Ranke Johannes
1
-1
/
+1
2024-04-07
Bump version and date
Johannes Ranke
1
-2
/
+2
2024-04-05
Delay loading of the rdkit module
Johannes Ranke
1
-3
/
+3
2023-11-12
Add pkgdown url to DESCRIPTON and _pkgdown.yml
Johannes Ranke
1
-1
/
+1
2023-11-11
Start new version, rename pp to ppp, more docs
Ranke Johannes
1
-2
/
+2
2023-11-10
Make an RStudio project and improve the docs
Ranke Johannes
1
-5
/
+5
2023-06-09
Move reticulate to suggests
Johannes Ranke
1
-3
/
+3
2022-11-11
Update docs, use run.sh on travis
Johannes Ranke
1
-2
/
+2
2021-11-19
Update tests and logs
Johannes Ranke
1
-1
/
+1
2021-11-18
Use reticulate instead of PythonInR, alanwood has moved
Johannes Ranke
1
-5
/
+5
2020-10-13
Adapt to changes in webchem
Johannes Ranke
1
-1
/
+0
2020-10-13
Temporarily remove @example tags
Johannes Ranke
1
-3
/
+3
2019-07-15
Add chent$emf() function based on devEMF
Johannes Ranke
1
-3
/
+4
2019-03-20
Use shQuote for filename creation in chent$pdf()
Johannes Ranke
1
-1
/
+1
2019-02-21
Use codecov and update docs
Johannes Ranke
1
-1
/
+2
2019-02-19
Use rsvg instead of grConvert
Johannes Ranke
1
-3
/
+2
2019-02-19
Change package URL to github to get source code links
Johannes Ranke
1
-1
/
+1
2019-02-19
Start using travis and update a test
Johannes Ranke
1
-5
/
+6
2018-09-27
Soil names for soil sorption tables
Johannes Ranke
1
-1
/
+1
2018-06-29
More details for soil degradation
Johannes Ranke
1
-1
/
+1
2018-06-22
Add country field to soil degradation data
Johannes Ranke
1
-1
/
+1
2018-05-20
Change pH_type to pH_medium
Johannes Ranke
1
-1
/
+1
2018-05-18
Revisited soil degradation and sorption
Johannes Ranke
1
-1
/
+1
2018-05-16
Vapour pressure and water solubility, use remark
Johannes Ranke
1
-1
/
+1
2018-03-01
Rebuild static documentation with current pkdown
Johannes Ranke
1
-2
/
+3
2017-06-13
Make grConvert optional as it vanished on Windows
Johannes Ranke
1
-5
/
+5
2017-03-17
Support a common template for depictions
Johannes Ranke
1
-1
/
+1
2017-03-15
Rerun pkgdown
Johannes Ranke
1
-1
/
+1
2017-03-06
Some updates
Johannes Ranke
1
-2
/
+2
2016-12-19
Make the pdf structures larger, update docs
Johannes Ranke
1
-1
/
+1
2016-12-05
Use new rdkit drawing code
Johannes Ranke
1
-6
/
+7
2016-10-14
Better handling of ambiguous names and "source"s
Johannes Ranke
1
-2
/
+2
2016-10-13
Fix retrieving pubchem infos for ambiguous names
Johannes Ranke
1
-2
/
+2
2016-10-08
Add a method to write cropped pdf files
Johannes Ranke
1
-1
/
+1
2016-09-27
PythonInR optional, adapt to current webchem
Johannes Ranke
1
-8
/
+17
2015-10-16
Some improvements, especially in loading chyaml
Johannes Ranke
1
-2
/
+2
2015-10-02
Some maintenance work
Johannes Ranke
1
-1
/
+1
2015-09-28
Several changes heading for a release to the public
Johannes Ranke
1
-3
/
+6
2015-09-11
Working version with basic functionality
Johannes Ranke
1
-2
/
+2
2015-08-26
Initial commit
Johannes Ranke
1
-0
/
+16
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