Can not run the examples/expl-4 and expl-9
Hello, i cannot run the expl-4 and expl-9, could it be a bug of some sort?
error information:
Program received signal SIGSEGV: Segmentation fault - invalid memory reference.
Backtrace for this error:
#0 0x1408a504531f in ???
at ./signal/../sysdeps/unix/sysv/linux/x86_64/libc_sigaction.c:0
#1 0x55f44a87ecb7 in get_xtb_constraint_block
at /home/qzy03/tools/crest/src/parsing/parse_xtbinput.f90:141
#2 0x55f44a87ecb7 in __parse_xtbinput_MOD_parse_xtb_inputfile
at /home/qzy03/tools/crest/src/parsing/parse_xtbinput.f90:85
#3 0x55f44a76e707 in parserc2_
at /home/qzy03/tools/crest/src/confparse.f90:2272
#4 0x55f44a778082 in parseflags_
at /home/qzy03/tools/crest/src/confparse.f90:2073
#5 0x55f44a43fe97 in crest
at /home/qzy03/tools/crest/src/crest_main.f90:56
#6 0x55f44a43eece in main
at /home/qzy03/tools/crest/src/crest_main.f90:26
Backtrace for this error:
#0 0xf82f904531f in ???
at ./signal/../sysdeps/unix/sysv/linux/x86_64/libc_sigaction.c:0
#1 0x58690b25e1fd in xtblmo_
at /home/qzy03/tools/crest/src/legacy_algos/protonate.f90:244
#2 0x58690b270bcb in protsmall_
at /home/qzy03/tools/crest/src/legacy_algos/tautomerize.f90:230
#3 0x58690b272f7d in tautomerize_
at /home/qzy03/tools/crest/src/legacy_algos/tautomerize.f90:93
#4 0x58690af909d4 in crest
at /home/qzy03/tools/crest/src/crest_main.f90:153
#5 0x58690af8eece in main
at /home/qzy03/tools/crest/src/crest_main.f90:26
system information:
OS: Ubuntu 24.04 LTS x86_64
Kernel: 6.8.0-38-generic
CPU: Intel Xeon E5-2683 v4 (32) @ 3.000GHz x2
CREST info:
Version:3.0.2
commit:(bf4e605) compiled by '@x99qzy03'
compiler:GNU (gcc 10.3.0)
build system:cmake-3.28.3
linear algebra backend: openblas
Thank you, WuHan
So the first issue in expl-4 I unfortunately can't reproduce. The second one for expl-9 I could, this seems some gcc related issue, #318 should be the fix
Thanks you, now i can pass expl-9 properly!The expl-4 have a same error infomation, but the precompiled version can pass it, i have no idea what happend, but most workflow could work now.
Have a nice day!
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