| generate_descriptors_from_sdf {rQSAR} | R Documentation |
Generate Molecular Descriptors from SDF File
Description
This function reads an SDF (Structure Data File) containing molecular structures and calculates molecular descriptors for each molecule.
Usage
generate_descriptors_from_sdf(sdf_file)
Arguments
sdf_file |
Path to the SDF file. |
Value
A matrix containing molecular descriptors for each molecule in the SDF file.
[Package rQSAR version 1.0.0 Index]