[gmx-users] Re: vaccum simulation error

raji ch11d029 at smail.iitm.ac.in
Tue Feb 19 12:32:21 CET 2013


for vacuum simulation , no need to specify cut-offs right. am using 8x8x8 box
and if we don't specify barostat it will again be a NVT simulations right.
vacuum simulations can be done only in NVT ??
sorry if am wrong . please clarify this doubt
thanks in advance



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