Re: [AMBER] Amber16 installation: Segmentation fault (core dumped) error when execute antechamber

From: Yuan Hu <Yuan.Hu.alkermes.com>
Date: Fri, 26 Jan 2018 19:50:44 +0000

1. ldd -v bin/teLeap

===> Machine 1: antechamber has segmentation fault

        linux-vdso.so.1 => (0x00007ffcacaa1000)
        libesets_pac.so => /lib64/libesets_pac.so (0x00007f89744db000)
        libm.so.6 => /lib64/libm.so.6 (0x00007f89741d9000)
        libc.so.6 => /lib64/libc.so.6 (0x00007f8973e16000)
        libpthread.so.0 => /lib64/libpthread.so.0 (0x00007f8973bfa000)
        libdl.so.2 => /lib64/libdl.so.2 (0x00007f89739f5000)
        /lib64/ld-linux-x86-64.so.2 (0x00007f8974658000)

        Version information:
        ./teLeap:
                libm.so.6 (GLIBC_2.2.5) => /lib64/libm.so.6
                libc.so.6 (GLIBC_2.3) => /lib64/libc.so.6
                libc.so.6 (GLIBC_2.14) => /lib64/libc.so.6
                libc.so.6 (GLIBC_2.7) => /lib64/libc.so.6
                libc.so.6 (GLIBC_2.2.5) => /lib64/libc.so.6
        /lib64/libesets_pac.so:
                libdl.so.2 (GLIBC_2.2.5) => /lib64/libdl.so.2
                ld-linux-x86-64.so.2 (GLIBC_2.3) => /lib64/ld-linux-x86-64.so.2
                libpthread.so.0 (GLIBC_2.2.5) => /lib64/libpthread.so.0
                libc.so.6 (GLIBC_2.3) => /lib64/libc.so.6
                libc.so.6 (GLIBC_2.3.3) => /lib64/libc.so.6
                libc.so.6 (GLIBC_2.2.5) => /lib64/libc.so.6
        /lib64/libm.so.6:
                ld-linux-x86-64.so.2 (GLIBC_PRIVATE) => /lib64/ld-linux-x86-64.so.2
                libc.so.6 (GLIBC_2.2.5) => /lib64/libc.so.6
                libc.so.6 (GLIBC_PRIVATE) => /lib64/libc.so.6
        /lib64/libc.so.6:
                ld-linux-x86-64.so.2 (GLIBC_2.3) => /lib64/ld-linux-x86-64.so.2
                ld-linux-x86-64.so.2 (GLIBC_PRIVATE) => /lib64/ld-linux-x86-64.so.2
        /lib64/libpthread.so.0:
                ld-linux-x86-64.so.2 (GLIBC_2.2.5) => /lib64/ld-linux-x86-64.so.2
                ld-linux-x86-64.so.2 (GLIBC_2.3) => /lib64/ld-linux-x86-64.so.2
                ld-linux-x86-64.so.2 (GLIBC_PRIVATE) => /lib64/ld-linux-x86-64.so.2
                libc.so.6 (GLIBC_2.14) => /lib64/libc.so.6
                libc.so.6 (GLIBC_2.3.2) => /lib64/libc.so.6
                libc.so.6 (GLIBC_PRIVATE) => /lib64/libc.so.6
                libc.so.6 (GLIBC_2.2.5) => /lib64/libc.so.6
        /lib64/libdl.so.2:
                ld-linux-x86-64.so.2 (GLIBC_PRIVATE) => /lib64/ld-linux-x86-64.so.2
                libc.so.6 (GLIBC_PRIVATE) => /lib64/libc.so.6
                libc.so.6 (GLIBC_2.2.5) => /lib64/libc.so.6

===> Machine 2: antechamber has no problem

        linux-vdso.so.1 => (0x00007ffd209fc000)
        libm.so.6 => /lib64/libm.so.6 (0x00007f0b4d3b2000)
        libc.so.6 => /lib64/libc.so.6 (0x00007f0b4cff0000)
        /lib64/ld-linux-x86-64.so.2 (0x00007f0b4d6cc000)

        Version information:
        ./teLeap:
                libm.so.6 (GLIBC_2.2.5) => /lib64/libm.so.6
                libc.so.6 (GLIBC_2.3) => /lib64/libc.so.6
                libc.so.6 (GLIBC_2.14) => /lib64/libc.so.6
                libc.so.6 (GLIBC_2.7) => /lib64/libc.so.6
                libc.so.6 (GLIBC_2.2.5) => /lib64/libc.so.6
        /lib64/libm.so.6:
                ld-linux-x86-64.so.2 (GLIBC_PRIVATE) => /lib64/ld-linux-x86-64.so.2
                libc.so.6 (GLIBC_2.14) => /lib64/libc.so.6
                libc.so.6 (GLIBC_PRIVATE) => /lib64/libc.so.6
                libc.so.6 (GLIBC_2.2.5) => /lib64/libc.so.6
        /lib64/libc.so.6:
                ld-linux-x86-64.so.2 (GLIBC_2.3) => /lib64/ld-linux-x86-64.so.2
                ld-linux-x86-64.so.2 (GLIBC_PRIVATE) => /lib64/ld-linux-x86-64.so.2

2. I didn't see any core* files dumped into the folder.

$gdb /usr/local/software/amber16/bin/to_be_dispatched/antechamber core*

GNU gdb (GDB) Red Hat Enterprise Linux 7.6.1-100.el7
Copyright (C) 2013 Free Software Foundation, Inc.
License GPLv3+: GNU GPL version 3 or later <http://gnu.org/licenses/gpl.html>
This is free software: you are free to change and redistribute it.
There is NO WARRANTY, to the extent permitted by law. Type "show copying"
and "show warranty" for details.
This GDB was configured as "x86_64-redhat-linux-gnu".
For bug reporting instructions, please see:
<http://www.gnu.org/software/gdb/bugs/>...
Reading symbols from /usr/local/software/amber16/bin/to_be_dispatched/antechamber...done.
/usr/local/software/amber16/bin/core*: No such file or directory.
(gdb) where
No stack.
(gdb)


Yuan


-----Original Message-----
From: Scott Brozell [mailto:sbrozell.rci.rutgers.edu]
Sent: Friday, January 26, 2018 1:41 PM
To: AMBER Mailing List
Subject: EXT: Re: [AMBER] Amber16 installation: Segmentation fault (core dumped) error when execute antechamber

[EXTERNAL]

Hi,

1.
There are a surprising number of differences. I do not see an ahh-haa one however. Using bin/teLeap instead of antechamber do you see similar differences between the two machines ?

2.
Although this smells increasingly like an issue with your workstation, please try these steps which i shortsightedly omitted before.
Note that core* denotes the core file dumped.

gdb /usr/local/software/amber16/bin/to_be_dispatched/antechamber core*
gdb> where

scott

On Fri, Jan 26, 2018 at 01:17:29PM +0000, Yuan Hu wrote:
> 1. The ldd information is as follow:
>
> ===> Machine 1: antechamber has segmentation fault $ldd -v antechamber
> linux-vdso.so.1 => (0x00007ffc0edbd000)
> libesets_pac.so => /lib64/libesets_pac.so (0x00007f9a90816000)
> libm.so.6 => /lib64/libm.so.6 (0x00007f9a90514000)
> libc.so.6 => /lib64/libc.so.6 (0x00007f9a90151000)
> libpthread.so.0 => /lib64/libpthread.so.0 (0x00007f9a8ff35000)
> libdl.so.2 => /lib64/libdl.so.2 (0x00007f9a8fd30000)
> /lib64/ld-linux-x86-64.so.2 (0x00007f9a90993000)
>
> Version information:
> ./antechamber:
> libm.so.6 (GLIBC_2.2.5) => /lib64/libm.so.6
> libc.so.6 (GLIBC_2.3) => /lib64/libc.so.6
> libc.so.6 (GLIBC_2.7) => /lib64/libc.so.6
> libc.so.6 (GLIBC_2.14) => /lib64/libc.so.6
> libc.so.6 (GLIBC_2.2.5) => /lib64/libc.so.6
> /lib64/libesets_pac.so:
> libdl.so.2 (GLIBC_2.2.5) => /lib64/libdl.so.2
> ld-linux-x86-64.so.2 (GLIBC_2.3) => /lib64/ld-linux-x86-64.so.2
> libpthread.so.0 (GLIBC_2.2.5) => /lib64/libpthread.so.0
> libc.so.6 (GLIBC_2.3) => /lib64/libc.so.6
> libc.so.6 (GLIBC_2.3.3) => /lib64/libc.so.6
> libc.so.6 (GLIBC_2.2.5) => /lib64/libc.so.6
> /lib64/libm.so.6:
> ld-linux-x86-64.so.2 (GLIBC_PRIVATE) => /lib64/ld-linux-x86-64.so.2
> libc.so.6 (GLIBC_2.2.5) => /lib64/libc.so.6
> libc.so.6 (GLIBC_PRIVATE) => /lib64/libc.so.6
> /lib64/libc.so.6:
> ld-linux-x86-64.so.2 (GLIBC_2.3) => /lib64/ld-linux-x86-64.so.2
> ld-linux-x86-64.so.2 (GLIBC_PRIVATE) => /lib64/ld-linux-x86-64.so.2
> /lib64/libpthread.so.0:
> ld-linux-x86-64.so.2 (GLIBC_2.2.5) => /lib64/ld-linux-x86-64.so.2
> ld-linux-x86-64.so.2 (GLIBC_2.3) => /lib64/ld-linux-x86-64.so.2
> ld-linux-x86-64.so.2 (GLIBC_PRIVATE) => /lib64/ld-linux-x86-64.so.2
> libc.so.6 (GLIBC_2.14) => /lib64/libc.so.6
> libc.so.6 (GLIBC_2.3.2) => /lib64/libc.so.6
> libc.so.6 (GLIBC_PRIVATE) => /lib64/libc.so.6
> libc.so.6 (GLIBC_2.2.5) => /lib64/libc.so.6
> /lib64/libdl.so.2:
> ld-linux-x86-64.so.2 (GLIBC_PRIVATE) => /lib64/ld-linux-x86-64.so.2
> libc.so.6 (GLIBC_PRIVATE) => /lib64/libc.so.6
> libc.so.6 (GLIBC_2.2.5) => /lib64/libc.so.6
>
> ===> Machine 2: antechamber has no problem $ldd -v antechamber
> linux-vdso.so.1 => (0x00007ffd6ab25000)
> libm.so.6 => /lib64/libm.so.6 (0x00007f475ee5c000)
> libc.so.6 => /lib64/libc.so.6 (0x00007f475ea9a000)
> /lib64/ld-linux-x86-64.so.2 (0x00007f475f176000)
>
> Version information:
> ./antechamber:
> libm.so.6 (GLIBC_2.2.5) => /lib64/libm.so.6
> libc.so.6 (GLIBC_2.3) => /lib64/libc.so.6
> libc.so.6 (GLIBC_2.7) => /lib64/libc.so.6
> libc.so.6 (GLIBC_2.14) => /lib64/libc.so.6
> libc.so.6 (GLIBC_2.2.5) => /lib64/libc.so.6
> /lib64/libm.so.6:
> ld-linux-x86-64.so.2 (GLIBC_PRIVATE) => /lib64/ld-linux-x86-64.so.2
> libc.so.6 (GLIBC_2.14) => /lib64/libc.so.6
> libc.so.6 (GLIBC_PRIVATE) => /lib64/libc.so.6
> libc.so.6 (GLIBC_2.2.5) => /lib64/libc.so.6
> /lib64/libc.so.6:
> ld-linux-x86-64.so.2 (GLIBC_2.3) => /lib64/ld-linux-x86-64.so.2
> ld-linux-x86-64.so.2 (GLIBC_PRIVATE) =>
> /lib64/ld-linux-x86-64.so.2
>
>
> 2. Run debug version of antechamber. Not working. See the on-screen output:
>
> [root.machine1 antechamber]# echo $AMBERHOME
> /usr/local/software/amber16
> [root.machine1 antechamber]# make clean /bin/rm -f *.o acdoctor am1bcc
> antechamber atomtype bondtype charmmgen database espgen match
> match_atomname parmcal parmchk parmchk2 prepgen residuegen respgen
> translate test-penalties test-int-part test-combination
> [root.machine1 antechamber]# make install AMBERBUILDFLAGS='-g -O0'
> gcc -c -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -o acdoctor.o acdoctor.c
> gcc -c -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -o eprintf.o eprintf.c
> gcc -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -g -O0 -g -O0 acdoctor.o eprintf.o \
> -L/usr/local/software/amber16/lib -lcifparse -lm -o acdoctor cp
> acdoctor /usr/local/software/amber16/bin/to_be_dispatched/acdoctor
> gcc -c -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -o am1bcc.o am1bcc.c
> gcc -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -g -O0 -g -O0 am1bcc.o eprintf.o \
> -lm -o am1bcc
> cp am1bcc /usr/local/software/amber16/bin/to_be_dispatched/am1bcc
> gcc -c -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -o antechamber.o antechamber.c
> gcc -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -g -O0 -g -O0 antechamber.o eprintf.o \
> -L/usr/local/software/amber16/lib -lcifparse -lm -o antechamber cp
> antechamber /usr/local/software/amber16/bin/to_be_dispatched/antechamber
> gcc -c -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -o atomtype.o atomtype.c
> gcc -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -g -O0 -g -O0 \
> atomtype.o eprintf.o -lm -o atomtype cp atomtype
> /usr/local/software/amber16/bin/to_be_dispatched/atomtype
> gcc -c -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -o bondtype.o bondtype.c
> gcc -c -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -o ncsu-penalties.o ncsu-penalties.c
> gcc -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -g -O0 -g -O0 \
> bondtype.o eprintf.o ncsu-penalties.o -lm -o bondtype cp bondtype
> /usr/local/software/amber16/bin/to_be_dispatched/bondtype
> gcc -c -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -o charmmgen.o charmmgen.c
> gcc -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -g -O0 -g -O0 \
> charmmgen.o eprintf.o -lm -o charmmgen cp charmmgen
> /usr/local/software/amber16/bin/to_be_dispatched/charmmgen
> gcc -c -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -o database.o database.c
> gcc -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -g -O0 -g -O0 \
> database.o eprintf.o -lm -o database cp database
> /usr/local/software/amber16/bin/to_be_dispatched/database
> gcc -c -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -o espgen.o espgen.c
> gcc -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -g -O0 -g -O0 \
> espgen.o eprintf.o -lm -o espgen
> cp espgen /usr/local/software/amber16/bin/to_be_dispatched/espgen
> gcc -c -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -o match.o match.c
> gcc -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -g -O0 -g -O0 \
> eprintf.o match.o -lm -o match
> cp match /usr/local/software/amber16/bin/to_be_dispatched/match
> gcc -c -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -o match_atomname.o match_atomname.c
> gcc -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -g -O0 -g -O0 \
> match_atomname.o eprintf.o -lm -o match_atomname cp match_atomname
> /usr/local/software/amber16/bin/to_be_dispatched/match_atomname
> gcc -c -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -o parmcal.o parmcal.c
> gcc -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -g -O0 -g -O0 \
> eprintf.o parmcal.o -lm -o parmcal cp parmcal
> /usr/local/software/amber16/bin/to_be_dispatched/parmcal
> gcc -c -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -o parmchk.o parmchk.c
> gcc -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -g -O0 -g -O0 \
> parmchk.o eprintf.o -lm -o parmchk cp parmchk
> /usr/local/software/amber16/bin/to_be_dispatched/parmchk
> gcc -c -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -o parmchk2.o parmchk2.c
> gcc -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -g -O0 -g -O0 \
> parmchk2.o eprintf.o -lm -o parmchk2 cp parmchk2
> /usr/local/software/amber16/bin/to_be_dispatched/parmchk2
> gcc -c -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -o prepgen.o prepgen.c
> gcc -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -g -O0 -g -O0 \
> eprintf.o prepgen.o -lm -o prepgen cp prepgen
> /usr/local/software/amber16/bin/to_be_dispatched/prepgen
> gcc -c -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -o residuegen.o residuegen.c
> gcc -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -g -O0 -g -O0 \
> residuegen.o eprintf.o -lm -o residuegen cp residuegen
> /usr/local/software/amber16/bin/to_be_dispatched/residuegen
> gcc -c -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -o respgen.o respgen.c
> gcc -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -g -O0 -g -O0 \
> respgen.o eprintf.o -lm -o respgen cp respgen
> /usr/local/software/amber16/bin/to_be_dispatched/respgen
> gcc -c -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -o translate.o translate.c
> gcc -fPIC -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DBINTRAJ -DHASGZ -DHASBZ2 -D__PLUMED_HAS_DLOPEN -g -O0 -g -O0 -g -O0 -g -O0 \
> translate.o eprintf.o -lm -o translate cp translate
> /usr/local/software/amber16/bin/to_be_dispatched/translate
> SFX= BINDIR=/usr/local/software/amber16/bin sh patch.sh
> [root.machine1 antechamber]# ls -l
> /usr/local/software/amber16/bin/to_be_dispatched/antechamber
> -rwxr-xr-x. 1 root root 423854 Jan 26 08:09
> /usr/local/software/amber16/bin/to_be_dispatched/antechamber
> [root.machine1 antechamber]#
> /usr/local/software/amber16/bin/to_be_dispatched/antechamber
> Segmentation fault (core dumped)
>
>
> Best,
> Yuan
>
>
> -----Original Message-----
> From: Scott Brozell [mailto:sbrozell.rci.rutgers.edu]
> Sent: Thursday, January 25, 2018 1:51 PM
> To: AMBER Mailing List
> Subject: EXT: Re: [AMBER] Amber16 installation: Segmentation fault
> (core dumped) error when execute antechamber
>
> [EXTERNAL]
>
> Hi,
>
> 1.
> What is different between your two workstations?
> (Run ldd on the workstation that works and compare to below.)
>
> On Wed, Jan 24, 2018 at 01:19:13PM +0000, Yuan Hu wrote:
> > $ldd /usr/local/software/amber16/bin/to_be_dispatched/antechamber
> > linux-vdso.so.1 => (0x00007ffcba57b000)
> > libesets_pac.so => /usr/lib64/libesets_pac.so (0x00007f268172e000)
> > libm.so.6 => /usr/lib64/libm.so.6 (0x00007f268142c000)
> > libc.so.6 => /usr/lib64/libc.so.6 (0x00007f2681069000)
> > libpthread.so.0 => /usr/lib64/libpthread.so.0 (0x00007f2680e4d000)
> > libdl.so.2 => /usr/lib64/libdl.so.2 (0x00007f2680c48000)
> > /lib64/ld-linux-x86-64.so.2 (0x00007f268188a000)
>
> 2.
> On the broken workstation a debug version of antechamber, run it, and send the output including the stack trace:
>
> cd AmberTools/src/antechamber/
> make clean
> make install AMBERBUILDFLAGS='-g -O0'
> ls -l /usr/local/software/amber16/bin/to_be_dispatched/antechamber
> /usr/local/software/amber16/bin/to_be_dispatched/antechamber

_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
This message may contain confidential or privileged information. If you are not the intended recipient, please advise the sender immediately by reply e-mail and delete this message and any attachments without retaining a copy. Thank you for your cooperation.

_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Fri Jan 26 2018 - 12:00:03 PST
Custom Search