From f908377f1de2e04ca3720d10084169c46a477ce2 Mon Sep 17 00:00:00 2001 From: Johannes Ranke Date: Mon, 28 Sep 2015 21:34:23 +0200 Subject: Several changes heading for a release to the public - Add tests - Add staticdocs - Documentation improvements - Several small code improvements --- inst/examples/caffeine.R | 4 ++++ 1 file changed, 4 insertions(+) create mode 100644 inst/examples/caffeine.R (limited to 'inst/examples/caffeine.R') diff --git a/inst/examples/caffeine.R b/inst/examples/caffeine.R new file mode 100644 index 0000000..ab794ac --- /dev/null +++ b/inst/examples/caffeine.R @@ -0,0 +1,4 @@ +caffeine <- chent$new("caffeine", source = "pubchem") +print(caffeine) +caffeine$get_rdkit() +plot(caffeine) -- cgit v1.2.1