Description Usage Arguments Value Examples
Reads file in sdf format.
1 | read_sdf(filename, coord, prop, to_numeric, delete_expl_hydr)
|
filename |
the name of the sdf file to be read |
coord |
whether to read coordinates of atoms; default:TRUE |
prop |
whether to read property values; default:TRUE |
to_numeric |
whether to convert property values to numbers; default:FALSE |
delete_expl_hydr |
whether to delete explicit hydrogens; default:FALSE |
Molecular database
1 2 3 4 5 | ## Load sdf file
## Not run:
mdb <- read_sdf("fname.sdf")
## End(Not run)
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