diff options
Diffstat (limited to 'DESCRIPTION')
| -rw-r--r-- | DESCRIPTION | 11 |
1 files changed, 6 insertions, 5 deletions
diff --git a/DESCRIPTION b/DESCRIPTION index 2201b9a..9b6be00 100644 --- a/DESCRIPTION +++ b/DESCRIPTION @@ -1,12 +1,12 @@ Package: chents Type: Package Title: Chemical Entities as R Objects -Version: 0.4.0 -Date: 2025-10-22 +Version: 0.4.1 +Date: 2026-03-05 Authors@R: c(person("Johannes", "Ranke", role = c("aut", "cre", "cph"), email = "johannes.ranke@jrwb.de")) Description: Utilities for dealing with chemical entities and associated - data as R objects. If Python and RDKit (> 2015.03) are installed and + data as R objects. If Python and 'RDKit' (> 2015.03) are installed and configured for use with 'reticulate', some basic chemoinformatics functions like the calculation of molecular weight and plotting of chemical structures in R graphics are available. @@ -19,13 +19,14 @@ Imports: reticulate Suggests: knitr, - testthat, + testthat (>= 3.0.0), covr, devEMF License: GPL LazyLoad: yes LazyData: yes Encoding: UTF-8 -URL: https://pkgdown.jrwb.de/chents, https://github.com/jranke/chents +URL: https://pkgdown.jrwb.de/chents/, https://github.com/jranke/chents Roxygen: list(markdown = TRUE, r6 = TRUE) RoxygenNote: 7.3.3 +Config/testthat/edition: 3 |