diff --git a/README.md b/README.md index 1ac4246..b01d429 100644 --- a/README.md +++ b/README.md @@ -32,14 +32,15 @@ Other installation ways are not implemented yet. ### Command-Line Tool -`gc-meox-tms` can be used as a command line tool in a Python console/Python scripts. To use the tool via the command line -you will need one or more `txt` files with chemical compounds represented as SMILES (one SMILES per line). The tool can -output results in flat `txt` format (one compound per line) or tab separated `tsv` format (all derivatives of a given molecule per line). +`gc-meox-tms` can be used as a command line tool to produce all MeOX/TMS derivatives of given compounds. To use it via +the command line you will need one or more `txt` files with chemical compounds represented as SMILES +(one SMILES per line). The tool can output results in flat `txt` format(one compound per line) or tab separated `tsv` +format (all derivatives of a given molecule per line). ```shell $ python -m gc_meox_tms \ -f \ -t \ - + ``` More parameters can be specified, such as number of cores or repeats. For more information run: ```shell