AMBER: leap single precision

From: Guanglei Cui <cuigl.csb.sunysb.edu>
Date: Thu, 07 Apr 2005 14:04:20 -0400

Hi, all

Has anyone created a single precision version of leap? I have a large
system to work on. The double precision leap couldn't handle it with a
4GB memory machine. I managed to compile leap with all "double" replaced
with "float". Leap runs, but it seems it is having trouble reading
frcmod files. I put back the original fortran.[ch], but it didn't solve
the problem. Can someone show me how to safely turn leap into single
precision? Thanks in advance.

Guanglei
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Received on Thu Apr 07 2005 - 19:53:01 PDT
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