Hi all,
when i try to compile antechamber, i get the following error message:
make test.antechamber
cd antechamber/tp; ./Run.tp
Running: /usr/local/amber7/exe/mopac.sh ANTECHAMBER_MUL.MOP
ANTECHAMBER_MUL.OUT
Unable to find mopac charges in ANTECHAMBER_MUL.OUT
Program error
make: *** [test.antechamber] Error 1
The 'ANTECHAMBER_MUL.OUT' file has just one line:
INPUT FILE MISSING OR EMPTY
This is the 'ANTECHAMBER_MUL.MOP' file:
AM1 MMOK GEO-OK CHARGE=0
remark line goes here
C -1.9590 1 0.1020 1 0.7950 1
C -1.2490 1 0.6020 1 -0.3030 1
C -2.0710 1 0.8650 1 1.9630 1
C -0.6460 1 1.8630 1 -0.2340 1
C -1.4720 1 2.1290 1 2.0310 1
C -0.7590 1 2.6270 1 0.9340 1
H -1.5580 1 2.7190 1 2.9310 1
S -2.7820 1 0.3650 1 3.0600 1
H -3.5410 1 0.9790 1 3.2740 1
H -0.7870 1 -0.0430 1 -0.9380 1
H 0.3730 1 2.0450 1 -0.7840 1
H -0.0920 1 3.5780 1 0.7810 1
H -2.3790 1 -0.9160 1 0.9010 1
This seems to be the same error as reported by Carsten Detering on Feb. 06
(antechamber+mopac+scf failed). However i'm using mopac7, redhat9 and
amber7. I did'nt find any responses to Carsten's mail. Can somebody give
me an idea abt. this problem? Thanx in advance.
Regards,
Arvind.
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Received on Mon Apr 05 2004 - 17:53:00 PDT
