SDFDataTable: SDF Data Table

In ChemmineR: Cheminformatics Toolkit for R

Description

Creates and HTML DataTable showing the compound image along with the fields in the compound data block. Using a browser, this table can be filtered and paged, among other things.

This uses the DT library to create the DataTable.

Usage

	SDFDataTable(sdfset)

Arguments

sdfset

An SDFSet object

Value

Returns the result of the datatable function from the DT library. An HTML file can be created from this value by calling the saveWidget function on it.

Author(s)

Kevin Horan

References

DT library: https://rstudio.github.io/DT/ DataTables javascript library: https://datatables.net/

Examples

	## Not run:  #depends on ChemmineOB
		library(ChemmineR)
		library(DT)
		data(sdfsample)

		# this will open a browser to display the result
		x=SDFDataTable(sdfsample[1:3]) 

		# if no GUI is available or you want to save the HTML result:
		saveWidget(x,"output.html")
	
## End(Not run)

	

ChemmineR documentation built on Feb. 28, 2021, 2:02 a.m.