write.set: Write a set file INPUT: set: data.frame with columns [target,...

In momeara/SEAR: R Tools for working with the Similarity Ensemble Approach Program

Description

warning note the order of the columns in the input idfferes in the order of the output set_fname: .set file name OUTPUT: creates <set_fname>

Usage

write.set(set, fname, target = "target", name = "name",
  compound = "compound", affinity = "affinity",
  description = "description", seaware_format = T)

momeara/SEAR documentation built on May 23, 2019, 6:09 a.m.