[gmx-users] Meaningless pressure values: NVT and NVE ensembles

Francesco Mambretti francesco.mambretti at studenti.unimi.it
Wed Nov 5 12:47:03 CET 2014


Thanks for the suggestion, but I fear it is not my case. 
I obtain the same
meaningless results with version 5.0.2 installed 
on another pc of my university.
I suspect it is something in Gromacs procedure
 for computing pressures.
However, thanks

Francesco





More information about the gromacs.org_gmx-users mailing list