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2025-10-22Adapt to new SMILES names at PubChemRanke Johannes1-1/+1
This may break some code using the old smiles names "PubChem_Canonical" and "PubChem_Isomeric" instead of the new smiles names "PubChem" (including isotopic and stereochemical information) and "PubChem_Connectivity" (only containing connectivity, but still canonical). Further changes in this commit: - A fix to the test target in the makefile - Use markdown syntax for link to objects from other packages in the documentation - Adapt the tests - Increase test coverage a bit
2021-11-19Add plot example, update static docsJohannes Ranke1-0/+7
2020-10-13Temporarily remove @example tagsJohannes Ranke1-7/+0
Due to r-lib/roxygen2#1158
2019-02-19Only plot when a Picture object is thereJohannes Ranke1-1/+1
grConvert is not needed for plotting
2019-02-19Skip plotting in examples if grConvert is missingJohannes Ranke1-1/+3
2016-12-19Make the pdf structures larger, update docsJohannes Ranke1-1/+0
2016-09-27PythonInR optional, adapt to current webchemJohannes Ranke1-1/+1
2015-10-16Some improvements, especially in loading chyamlJohannes Ranke1-2/+1
2015-09-28Several changes heading for a release to the publicJohannes Ranke1-0/+23
- Add tests - Add staticdocs - Documentation improvements - Several small code improvements

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