From 7cc5df2ad1e2a1aa5c6d4d9f5865491c6b30ee2a Mon Sep 17 00:00:00 2001
From: Johannes Ranke <jranke@uni-bremen.de>
Date: Wed, 26 Aug 2015 13:24:57 +0200
Subject: Initial commit

---
 man/chent.Rd | 33 +++++++++++++++++++++++++++++++++
 man/pai.Rd   | 27 +++++++++++++++++++++++++++
 2 files changed, 60 insertions(+)
 create mode 100644 man/chent.Rd
 create mode 100644 man/pai.Rd

(limited to 'man')

diff --git a/man/chent.Rd b/man/chent.Rd
new file mode 100644
index 0000000..ed304f5
--- /dev/null
+++ b/man/chent.Rd
@@ -0,0 +1,33 @@
+% Generated by roxygen2 (4.1.1): do not edit by hand
+% Please edit documentation in R/chent.R
+\docType{class}
+\name{chent}
+\alias{chent}
+\title{An R6 class for chemical entities with associated data}
+\format{An \code{\link{R6Class}} generator object}
+\usage{
+chent
+}
+\description{
+The class is initialised with an identifier. Chemical information is retrieved
+from the internet.
+}
+\section{Fields}{
+
+\describe{
+\item{\code{identifier}}{The identifier that was used to initiate the object, with attribute 'source'}
+
+\item{\code{inchikey}}{InChI Key, with attribute 'source'}
+
+\item{\code{smiles}}{SMILES code, with attribute 'source'}
+
+\item{\code{mw}}{Molecular weight, with attribute 'source'}
+
+\item{\code{pubchem}}{List of information retreived from PubChem}
+}}
+\examples{
+oct <- chent$new("1-octanol")
+print(oct)
+}
+\keyword{data}
+
diff --git a/man/pai.Rd b/man/pai.Rd
new file mode 100644
index 0000000..c366991
--- /dev/null
+++ b/man/pai.Rd
@@ -0,0 +1,27 @@
+% Generated by roxygen2 (4.1.1): do not edit by hand
+% Please edit documentation in R/chent.R
+\docType{class}
+\name{pai}
+\alias{pai}
+\title{An R6 class for pesticidal active ingredients and associated data}
+\format{An \code{\link{R6Class}} generator object}
+\usage{
+pai
+}
+\description{
+The class is initialised with an identifier which is generally an ISO common name.
+Additional chemical information is retrieved from the internet.
+}
+\section{Fields}{
+
+\describe{
+\item{\code{iso}}{ISO common name according to ISO 1750 as retreived from www.alanwood.net/pesticides}
+
+\item{\code{alanwood}}{List of information retreived from www.alanwood.net/pesticides}
+}}
+\examples{
+atr <- pai$new("atrazine")
+print(atr)
+}
+\keyword{data}
+
-- 
cgit v1.2.1