AMBER: amber memory usage

From: Ed Pate <pate.math.wsu.edu>
Date: Fri, 14 Apr 2006 15:45:59 -0700 (PDT)

Dear Amber users:

I am trying to determine the memory usage from an Amber simulation as I
try to move the simulation to another computer.

The relevant part of the Sander output (I think) is

| Memory Use Allocated
| Real 7390458
| Hollerith 683261
| Integer 8078098
| Max Pairs 30967142
| Max Rstack 7500000
| Max Istack 5000000
| Duplicated 0 dihedrals
| Duplicated 0 dihedrals

Do I determine useage as (Real+Hollerith+Integer)*8 ?

Thanks for the help.

Ed Pate
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Received on Sun Apr 16 2006 - 06:07:07 PDT
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