Open glesica opened 2 years ago
The newest version of fpadmet doesn't require that input files end in .smi so we can go back to using the original file extension in the Nextflow workflow (.admet). Basically, we can remove the mv command in that stage once we've upgraded.
mv
The newest version of fpadmet doesn't require that input files end in .smi so we can go back to using the original file extension in the Nextflow workflow (.admet). Basically, we can remove the
mvcommand in that stage once we've upgraded.