diff --git a/README.md b/README.md index c085986..6442c79 100644 --- a/README.md +++ b/README.md @@ -23,7 +23,7 @@ gcenter -c system.gro -f trajectory.xtc -o output_trajectory.xtc Usage: gcenter [OPTIONS] --structure --output Options: - -c, --structure + -s, --structure Path to a gro, pdb, pqr, or tpr file containing the system structure. If a trajectory is also provided, the coordinates from the structure file are ignored. -f, --trajectory [...] @@ -62,7 +62,7 @@ Options: [default: NaN] - -s, --step + -t, --step Center and write only every th frame of the trajectory to the output file. This option is only applicable when trajectory file(s) is/are provided.