Dear all,
when I used the msi2lmp tool to generate the
data file. But I encountered the following problems
Dear all,
when I used the msi2lmp tool to generate the
data file. But I encountered the following problems
I think the error message is self-explanatory.
If your MSI force field file does not have
terms for your system, then apparently the
conversion tool complains. I suppose you
need to add terms to your force field file.
Steve