From: Karol Kaszuba (
Date: Thu Nov 08 2007 - 06:00:33 CST


  Based on the literature and previous posts I found that CHARMM forcefield does not yield the correct
  bilayer geometry in NPT ensemble, however there are many articles in which we can find membrane-protein
  simulation in NPT and no one mentions about the problems with bilayer structure - so I am little
  confused - can I use the CHARMM forcefield (release c32b1) to simulate POPC membrane in NPT or
  do I have to use NPgamma(surface tension)T or NPAT ?

  Thank you in advance,




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