From: Andriy Kovalenko via AMBER <amber.ambermd.org>
> What are the units of "density" input in &SPECIES entries of *.inp files
> for the rism1d executable?
See section 7.4.1 ("rism1d") in the Reference Manual. Default units are mol/liter (M), but you can use the units option to use a variety of different input densities.
....hope this helps....dac
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Mon Apr 24 2023 - 19:30:02 PDT
