Some more playing with sleap yields this:
1. solvateOct is not implemented. This is a pretty important command.
2. sleap gave a good message: "solvatoct: command not found!", but after
that, it continued on with the next command. We need to think about some way
to distinguish between interactive and non-interactive environments.
Probably, using stdin should be "interactive", but using "-f" should be
non-interactive. Then, in non-interactive mode, a missing command should be a
fatal error.
This way, if someone just mis-spells a command in interactive mode, they can
fix it, but in a "batch" mode, we want to flag errors, and quit.
Does this make sense? Better suggestions are welcome.
...dac
Received on Sun Apr 22 2007 - 06:07:31 PDT
