Dear Amber users !
For the test of the simulation with PBC I would like to create a simple
system containing the mix of TIP3P water with ethanol and placing some
glucose molecules inside. Previously I performed simulations of proteins
solvated in a water box but never the pure liquid. Could you please suggest
to me what would be the right order of tleap commands to create such a
multi-component solvent system ?
Many thanks in advance
Enrico
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Received on Thu Oct 17 2024 - 02:00:02 PDT
