Justin A. Lemkul wrote:
It is possible this is a bug related to nst*out/energy/log being writing
every 5 steps and assuming init_step = 0 (i.e. writing at 100 ps
rather than 240 ps, based on your initial settings). What version of
Gromacs is this?
Actually, this wouldn't be considered
Anna Marabotti wrote:
Dear gmx-users,
since I'm sending my simulations to a system with a queue with a
wallclock time of 24 h, I necessarily have to simulate small parts of my
simulation, that I "stick" together at the end with trjconv. To continue
my simulations, I'm using the .cpt file. He
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