Dear Amber users,
I would like to use the TIP4P solvent model with the amber force field. After some reading I found that using the TIP4P-Ew was recommended when running PME simulations.
However I also run non periodic simulations (using solvateCap in tleap to create for instance a solvent sphere that I constrain later in the simulation). Can I also use the same water parameters (TIP4P-Ew) for such simulations or shall I switch to normal TIP4P in this case?
Thanks in advance.
Peter Schmidtke, PhD
......................................
Scientific Project Manager
Discngine
Paris
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Received on Mon Jul 27 2015 - 04:30:02 PDT
