Dear AMBER users,
Compiling the sander_classic code with cf90 compiler on a CRAY SV1-B, using
the unicos_mp machine file provides the following errors:
cf90-211 f90: ERROR $MAIN, File = _force_.f, Line = 14, Column = 6
Continuation is not allowed for this statement.
IF (LGRON) THEN
^
cf90-416 f90: ERROR FORCE, File = _force_.f, Line = 879, Column = 14
The conditional expression must be type logical.
subroutine pairr (npair,nhb,iar1,ipairs)
^
cf90-1295 f90: WARNING PAIRR, File = _force_.f, Line = 2180, Column = 18
"PAIRR" is defined or referenced at line 847 (_force_.f) and here. The
number of arguments do not match. Expected 5, but found 4.
ICNT = ICNT + 3
cf90-7219 f90: WARNING DIPLE, File = _force_.f, Line = 2404
This shared object update in the parallel region may need a guard.
ICNT = ICNT + 3
cf90-7219 f90: WARNING DIPLE, File = _force_.f, Line = 2412
This shared object update in the parallel region may need a guard.
PPER = PPER + SQRT(PX*PX + PY*PY + PZ*PZ)
cf90-7219 f90: WARNING DIPLE, File = _force_.f, Line = 2415
This shared object update in the parallel region may need a guard.
EMX = EMX + PX
cf90-7219 f90: WARNING DIPLE, File = _force_.f, Line = 2416
This shared object update in the parallel region may need a guard.
EMY = EMY + PY
cf90-7219 f90: WARNING DIPLE, File = _force_.f, Line = 2417
This shared object update in the parallel region may need a guard.
EMZ = EMZ + PZ
cf90-7219 f90: WARNING DIPLE, File = _force_.f, Line = 2418
This shared object update in the parallel region may need a guard.
Any help to solve these errors will be acknowledged.
Please note that the sander code compiles well.
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
PD. Dr. Didier ROGNAN
Department of Applied BioSciences - ETH ____/ __ __/ / /
Wintherturerstr. 190 __/ / __ /
CH-8057 Zuerich _____/ __/ __/ __/
tel:+41.1.635 60 36
fax:+41.1.635 68 84
E-mail: didier_at_pharma.ethz.ch
WWW: http://www.pharma.ethz.ch/~didier
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Received on Wed Feb 16 2000 - 04:05:34 PST
