From 5bec469048899cfd785dec4f91ec3840cff18adb Mon Sep 17 00:00:00 2001 From: Johannes Ranke Date: Tue, 27 Sep 2016 16:43:15 +0200 Subject: Add a bit of info to README --- GNUmakefile | 1 + README.md | 12 ++++++++++++ docs/index.html | 14 ++++++++++++++ 3 files changed, 27 insertions(+) diff --git a/GNUmakefile b/GNUmakefile index b88fb85..d15273d 100644 --- a/GNUmakefile +++ b/GNUmakefile @@ -11,6 +11,7 @@ usage: @echo "Usage: make TARGET with TARGET being:" @echo "" @echo " roxygen - Roxygenize." + @echo " sd - Roxygenize and build static docs." @echo " build - Build source package." @echo " check - Run check on the package." @echo " crancheck - Run CRAN check on the package." diff --git a/README.md b/README.md index b0647b3..2db5787 100644 --- a/README.md +++ b/README.md @@ -16,3 +16,15 @@ This means: You should have received a copy of the GNU General Public License along with this program. If not, see + +## Features + +- Some chemical information is retrieved from the PubChem website using the webchem +package +- If PythonInR is installed and configured, and RDKit is available via +PythonInR, some additional chemical information is computed and a 2D graph can +be plotted +- Additional information can be read from a local .yaml file + +Some examples are available from the +[Reference on github](https://jranke.github.io/chents/reference.html). diff --git a/docs/index.html b/docs/index.html index 579c9f3..3582067 100644 --- a/docs/index.html +++ b/docs/index.html @@ -71,6 +71,20 @@ You should have received a copy of the GNU General Public License along with this program. If not, see <http://www.gnu.org/licenses/> +

Features

+ + + +

Some examples are available from the +Reference on github.

+