write_sdf: Write an SDF

Description Usage Arguments Value

View source: R/write_sdf.R

Description

write_sdf can write the output of combine_sdf into an SDF file. The function is a wrapper for write.table with settings adjusted for valid SDF files. The path passed to the function does not have to be suffixed with ".SDF". The function will append the correct file suffix.

Usage

1
write_sdf(sdf, path)

Arguments

sdf

The SDF as a data frame. Accepts the output data frame from combine_sdf

path

The file path for the SDF. If it does not end with ".SDF", the appropriate file suffix will be applied.

Value

A data frame in the format of an SDF.


awqx/qsarr documentation built on Oct. 2, 2021, 7:05 a.m.