AMBER Archive (2007)

Subject: AMBER: another sander bug?

From: Nursultan Bogatov (sunny_mongolia_at_hotmail.com)
Date: Fri Jan 26 2007 - 00:43:13 CST

--- src/sander/mdfil.f
+++ src/sander/mdfil.f
@@ -290,7 +290,7 @@ integer function iargc_wrap()

    if (numgroup > 1 .and. groups(1:1) /= ' ') then
       ia = 0
- istart = 0
+ istart = 1
       iend = len(groupbuffer)

       do while (istart < iend)

P.S. Although SANDER glorious module, it have a problem too:
FORTRAN, FORTRAN and ... FORTRAN :-)

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