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--- > EELEC = -55078.4221 EHBOND = 0.0000 RESTRAINT = 0.0000 ------------- I can see only trivial difference (.4222 vs .4221) as you said. So, I wonder if I basically don't have to worry about this problem..is it fine? Or, do I need to change .4222 into .4221 in mdout.trx.cpln.save file? Also...although I can neglect possible failure things, I finally got an error in ../Run.dip like below. ---------------------------------- cd cnstph; ./Run.cnstph diffing mdout.save with mdout possible FAILURE: check mdout.dif ============================================================== diffing cpout.save with cpout PASSED ============================================================== cd rdc; ./Run.dip Killed ./Run.dip: Program error make: *** [test.sander.no_lmod] Error 1 ---------------------------------- Again, I'm installing AMBER8 on AMD cluster (2.4Ghz) with RedHat 7.2 by using pgf90 3.3-2. As I mentioned in my previous email, I followed basic procedures and some suggestions posted in this forum early. Could you help me solve this problem? best, Hwankyu. Quoting "David A. Case" <case.scripps.edu>: > On Tue, Nov 23, 2004, Hwankyu Lee wrote: > > > > > PGC/x86 Linux/x86 3.3-2: compilation completed with warnings > > This is just a warning; don't worry about it. > > > > > When I tried "make test", it passed for a while, and then I got some > failure > > like below, and then finally got error in ./Run.dip like below. > > ============================================================== > > cd trx; ./Run.trx.cpln > > diffing mdout.trx.cpln.save with mdout.trx.cpln > > possible FAILURE: check mdout.trx.cpln.dif > > Please do what the message suggests: check mdout.trx.cpln.dif. Chances are > good that you will see only trivial differences between your output and > the saved output. > > ...good luck....dac > > ----------------------------------------------------------------------- > The AMBER Mail Reflector > To post, send mail to amber.scripps.edu > To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu > > > ----------------------------------------------------------------------- The AMBER Mail Reflector To post, send mail to amber.scripps.edu To unsubscribe, send "unsubscribe amber" to majordomo.scripps.eduReceived on Wed Nov 24 2004 - 14:53:00 PST