aboutsummaryrefslogtreecommitdiff
path: root/pkg/man/pfm_chent.Rd
diff options
context:
space:
mode:
Diffstat (limited to 'pkg/man/pfm_chent.Rd')
-rw-r--r--pkg/man/pfm_chent.Rd34
1 files changed, 34 insertions, 0 deletions
diff --git a/pkg/man/pfm_chent.Rd b/pkg/man/pfm_chent.Rd
new file mode 100644
index 0000000..c62e8cf
--- /dev/null
+++ b/pkg/man/pfm_chent.Rd
@@ -0,0 +1,34 @@
+% Generated by roxygen2 (4.1.0.9001): do not edit by hand
+% Please edit documentation in R/pfm_chent.R
+\docType{class}
+\name{pfm_chent}
+\alias{pfm_chent}
+\title{R6 class for holding a chemical entity}
+\format{An \code{\link{R6Class}} generator object.}
+\usage{
+pfm_chent
+}
+\description{
+An R6 class for holding information about a chemical entity
+}
+\section{Fields}{
+
+\describe{
+\item{\code{acronym}}{Acronym for local use}
+
+\item{\code{smiles}}{SMILES code}
+
+\item{\code{mw}}{Molecular weight}
+
+\item{\code{main_source}}{Main source of information}
+
+\item{\code{transformations}}{}
+
+\item{\code{sorption_endpoints}}{}
+}}
+\examples{
+atrazine <- pfm_chent("atrazine", smiles = "Clc1nc(nc(n1)NC(C)C)NCC", mw = 215.68)
+print(atrazine)
+}
+\keyword{data}
+

Contact - Imprint