On Wed, Apr 27, 2016, Zhenyu Meng wrote:
> I'm trying to use Amber sander debugging mode, and my input script is as
> followed.
> When I run the simulation, no forcedump.dat file is generated.
Try putting the debugf namelist after the ewald one. This is just a guess,
but worth a try. (It may be that sander is not rewinding the input file after
reading the &ewald namelist.) Or, perform a trial calculation with no &ewald
block.
...dac
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Received on Wed Apr 27 2016 - 05:30:03 PDT
