VMD-L Mailing List

From: David Chalmers (david.chalmers_at_vcp.monash.edu.au)
Date: Mon Sep 01 2003 - 03:06:35 CDT

Hi All,

Can anybody provide advice on the best methods to use for constant
pressure/temperature simulations and what are reasonable values for the
parameters? For example with Langevin pressure, what values do people use
for LangevinPistonPeriod and LangevinPistonDecay?

Regards

David

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David Chalmers Lab: 9903 9110
Victorian College of Pharmacy Fax: 9903 9582
381 Royal Pde, Parkville, Vic 3053 http://synapse.vcp.monash.edu.au
Australia David.Chalmers_at_vcp.monash.edu.au
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