[AMBER-Developers] Issues building git master on SDSC comet

From: Ross Walker <ross.rosswalker.co.uk>
Date: Tue, 22 Mar 2016 16:18:44 -0700

[rcw.comet-ln3 amber]$ cat /etc/redhat-release
CentOS release 6.7 (Final)

./configure intel
(I said yes to download the miniconda stuff)
make

make[3]: Entering directory `/home/rcw/amber/AmberTools/src/quick/src'
make[3]: Nothing to be done for `all'.
make[3]: Leaving directory `/home/rcw/amber/AmberTools/src/quick/src'
ifort -o /home/rcw/amber/bin/quick src/main.o ./src/quick_lib.a ./src/modules/quick_modules.a ./src/subs/quick_subs.a src/fake_amber_interface.o -shared-intel -fPIC -I/home/rcw/amber/include -I/home/rcw/amber/include -ip -O3 -xHost -L/home/rcw/amber/lib -larpack -llapack -lblas -lxblas-amb -lsvml
make[2]: Leaving directory `/home/rcw/amber/AmberTools/src/quick'
(if [ "no" = "no" ]; then \
                make python_serial ;\
        fi;\
        )
make[2]: Entering directory `/home/rcw/amber/AmberTools/src'
(cd parmed && /home/rcw/amber/bin/amber.python setup.py install --no-setuptools -f --prefix=/home/rcw/amber --install-scripts=/home/rcw/amber/bin)
OpenBLAS: pthread_creat error in blas_thread_init function. Error code:11
make[2]: *** [parmed] Error 1
make[2]: Leaving directory `/home/rcw/amber/AmberTools/src'
make[1]: *** [serial] Error 2
make[1]: Leaving directory `/home/rcw/amber/AmberTools/src'
make: *** [install] Error 2

[rcw.comet-ln3 amber]$ ifort -V
Intel(R) Fortran Intel(R) 64 Compiler XE for applications running on Intel(R) 64, Version 15.0.2.164 Build 20150121
Copyright (C) 1985-2015 Intel Corporation. All rights reserved.

[rcw.comet-ln3 amber]$ module list
Currently Loaded Modulefiles:
  1) gnutools/2.69 2) intel/2015.2.164

/\
\/
|\oss Walker

---------------------------------------------------------
| Associate Research Professor |
| San Diego Supercomputer Center |
| Adjunct Associate Professor |
| Dept. of Chemistry and Biochemistry |
| University of California San Diego |
| NVIDIA Fellow |
| http://www.rosswalker.co.uk | http://www.wmd-lab.org |
| Tel: +1 858 822 0854 | EMail:- ross.rosswalker.co.uk |
---------------------------------------------------------

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Received on Tue Mar 22 2016 - 16:30:03 PDT
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