Hello all
I am compiling amber10 in linux, I have compiled it successfully in serial but
when i run the qmmm test I got folowing error:
cd qmmm2/2pk4 && ./Run.2pk4_stan
Segmentation fault
./Run.2pk4_stan: Program error
make: *** [test.sander.DIVCON] Error 1
After that I compiled it successfully in parallel, when again I run qmmm test I
got following error:
cd qmmm2/MG_QM_water_MM_AM1_qmcut_ADDMM && ./Run.MG_QM_water_MM_MD
diffing MG_QM_water_MM_MD.out.save with MG_QM_water_MM_MD.out
PASSED
==============================================================
make[1]: Leaving directory `/home/sangita/amber10/test'
export TESTsander=/home/sangita/amber10/exe/sander.MPI; make test.sander.DFTB
make[1]: Entering directory `/home/sangita/amber10/test'
cd qmmm_DFTB/crambin_DFTB && ./Run.crambin
DFTB SLKO files not found - Skipping Test...
cd qmmm_DFTB/crambin_DFTB && ./Run.crambin_md_hot_start
DFTB SLKO files not found - Skipping Test...
I want to know that, will I face the problem in future?
If there will be problem then how I can resolve it?
Thanks for any suggestion.
With regard
Sangita Kachhap
JRF
BIC,IMTECH
CHANDIGARH
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Received on Fri May 28 2010 - 07:30:07 PDT
