Closed alephreish closed 3 months ago
Hello Andrey
The problem seems to be that T-coffee is not on your PATH. In this specific mode T-Coffee calls itself.
From what I see in your output, having t_coffee in
/opt/t_coffee/bin/
Should do the trick
You should use legacy blast
Cheers
Cedric
--
Dr Cedric Notredame, PhD ORCID - https://orcid.org/0000-0003-1461-0988https://urldefense.com/v3/__https://orcid.org/0000-0003-1461-0988__;!!D9dNQwwGXtA!SMc4j2BjfVrbtIkNLgH9GMyKYaeMTwLyLZOY3ekmpRVksWfqAb3vYibX4HPTOmrkgdLvI8sL7E0LUiwBHJhlxDvKNUIvshE$
On 17 Jul 2024, at 13:55, Andrey Rozenberg @.***> wrote:
$ t_coffee -version PROGRAM: T-COFFEE Version_13.46.0.919e8c6b (2023-07-07 22:06:42 - Revision 29996c5 - Build 980)
I cannot make t_coffee run psicoffee. See a minimal example below. Also, not sure if it uses blast+ or legacy blast - which one should I use to create a local database?
$ cat test.fas
1 MAYWLQAASLLVLLALSPGADAAAAQHLCGSHLVDALYLVCGEKGFFYNPKRDLLYCFWFLSPKSAKENEEYPFKDQMEMMVKRGIVEQCCHKPCNIFDLQNYCN 2 MALWMRLLPLLALLALWEPNPAQAFVNQHLCGSHLVEALYLVCGERGFFYTPKSRRGVEDPQVTQLELGGGPGAGDLQTLALEVAQQKRGIVDQCCTSICSLYQLENYCN 3 MALWIRSLPLLALLALSGPGTSQAAANQHLCGSHLVEALYLVCGERGFFYSPKARRDVERPLVSSPLHGEVGELPFQQEEFEKVKRGIVEQCCHNTCSLYQLENYCN $ t_coffee test.fas -mode=psicoffee
--ERROR: # [FATAL:T-COFFEE]
# #
$ t_coffee test.fas -method=psicoffee_msa
PROGRAM: T-COFFEE Version_13.46.0.919e8c6b (2023-07-07 22:06:42 - Revision 29996c5 - Build 980) -full_log S [0] -genepred_score S [0] nsd -run_name S [0] -mem_mode S [0] mem -extend D [1] 1 -extend_mode S [0] very_fast_triplet -max_n_pair D [0] 10 -seq_name_for_quadruplet S [0] all -compact S [0] default -clean S [0] no -do_self FL [0] 0 -do_normalise D [0] 1000 -template_file S [0] -template_dirE S [0] ./ -setenv S [0] 0 -export S [0] 0 -template_mode S [0] -flip D [0] 0 -remove_template_file D [0] 0 -profile_template_file S [0] -in S [0] -seq S [1] test.fas -aln S [0] -method_limits S [0] -method S [1] psicoffee_msa -lib S [0] -profile S [0] -profile1 S [0] -profile2 S [0] -pdb S [0] -relax_lib D [0] 1 -filter_lib D [0] 0 -shrink_lib D [0] 0 -out_lib W_F [0] no -out_lib_mode S [0] primary -lib_only D [0] 0 -outseqweight W_F [0] no -seq_source S [0] ANY -cosmetic_penalty D [0] 0 -gapopen D [0] 0 -gapext D [0] 0 -fgapopen D [0] 0 -fgapext D [0] 0 -nomatch D [0] 0 -newtree W_F [0] default -tree W_F [0] NO -usetree R_F [0] -tree_mode S [0] nj -distance_matrix_mode S [0] ktup -distance_matrix_sim_mode S [0] idmat_sim1 -quicktree FL [0] 0 -outfile W_F [0] default -maximise FL [1] 1 -output S [0] aln html -len D [0] 0 -infile R_F [0] -matrix S [0] default -fs_matrix S [0] idmat -fs_gop D [0] 1 -fs_gep D [0] 1 -tg_mode D [0] 1 -profile_mode S [0] cw_profile_profile -profile_comparison S [0] profile -dp_mode S [0] linked_pair_wise -ktuple D [0] 1 -ndiag D [0] 0 -diag_threshold D [0] 0 -diag_mode D [0] 0 -sim_matrix S [0] vasiliky -transform S [0] -extend_seq FL [0] 0 -outorder S [0] input -inorder S [0] aligned -seqnos S [0] off -case S [0] keep -cpu D [0] 0 -ulimit D [0] -1 -maxnseq D [0] -1 -maxlen D [0] -1 -sample_dp D [0] 0 -weight S [0] default -seq_weight S [0] no -align FL [1] 1 -mocca FL [0] 0 -domain FL [0] 0 -start D [0] 0 -len D [0] 0 -scale D [0] 0 -mocca_interactive FL [0] 0 -method_evaluate_mode S [0] default -color_mode S [0] new -aln_line_length D [0] 0 -evaluate_mode S [0] triplet -get_type FL [0] 0 -clean_aln D [0] 0 -clean_threshold D [1] 1 -clean_iteration D [1] 1 -clean_evaluate_mode S [0] t_coffee_fast -extend_matrix FL [0] 0 -prot_min_sim D [0] 0 -prot_max_sim D [100] 100 -psiJ D [0] 3 -psitrim_mode S [0] regtrim -psitrim_tree S [0] codnd -psitrim D [100] 100 -prot_min_cov D [90] 90 -pdb_type S [0] d -pdb_min_sim D [35] 35 -pdb_max_sim D [100] 100 -pdb_min_cov D [50] 50 -pdb_blast_server W_F [0] EBI -blast W_F [0] -blast_server W_F [0] EBI -pdb_db W_F [0] pdb -protein_db W_F [0] uniref50 -method_log W_F [0] no -struc_to_use S [0] -cache W_F [0] use -print_cache FL [0] 0 -align_pdb_param_file W_F [0] no -align_pdb_hasch_mode W_F [0] hasch_ca_trace_bubble -external_aligner S [0] NO -msa_mode S [0] tree -et_mode S [0] et -master S [0] no -blast_nseq D [0] 0 -lalign_n_top D [0] 10 -iterate D [0] 0 -trim D [0] 0 -split D [0] 0 -trimfile S [0] default -split D [0] 0 -split_nseq_thres D [0] 0 -split_score_thres D [0] 0 -check_pdb_status D [0] 0 -clean_seq_name D [0] 0 -seq_to_keep S [0] -dpa_master_aln S [0] -dpa_maxnseq D [0] 0 -dpa_min_score1 D [0] -dpa_min_score2 D [0] -dpa_keep_tmpfile FL [0] 0 -dpa_debug D [0] 0 -multi_core S [0] templates_jobs_relax_msa_evaluate -n_core D [0] 1 -thread D [0] 1 -max_n_proc D [0] 1 -lib_list S [0] -prune_lib_mode S [0] 5 -tip S [0] none -rna_lib S [0] -no_warning D [0] 0 -run_local_script D [0] 0 -proxy S [0] unset -email S [0] -clean_overaln D [0] 0 -overaln_param S [0] -overaln_mode S [0] -overaln_model S [0] -overaln_threshold D [0] 0 -overaln_target D [0] 0 -overaln_P1 D [0] 0 -overaln_P2 D [0] 0 -overaln_P3 D [0] 0 -overaln_P4 D [0] 0 -exon_boundaries S [0] -display D [0] 100
INPUT FILES Input File (S) test.fas Format fasta_seq Input File (M) psicoffee_msa
Identify Master Sequences [no]:
Master Sequences Identified INPUT SEQUENCES: 3 SEQUENCES [PROTEIN] Input File test.fas Seq 1 Length 105 type PROTEIN Struct Unchecked Input File test.fas Seq 2 Length 110 type PROTEIN Struct Unchecked Input File test.fas Seq 3 Length 107 type PROTEIN Struct Unchecked
Multi Core Mode (read): 1 processor(s):
--- Process Method/Library/Aln Stest.fas
xxx Retrieved Stest.fas
--- Process Method/Library/Aln Mpsicoffee_msa
pid 1602719 -- COMMAND FAILED: dynamic.pl -seq /var/tmp/tco/tco7ybgty2j1602712//73061602718t9uia272 -outfile /var/tmp/tco/tco7ybgty2j1602712//73061602718t9uia271 -method psicoffee_msa >>/dev/null 2>&1
xxx Retrieved Mpsicoffee_msa
All Methods Retrieved
** ERROR *****
You have not provided any method or enough Sequences[FATAL]
If you have used the '-in' Flag, ADD the methods you wish to use:
-in
And make sure you provide at least TWO sequences /opt/t_coffee/bin/t_coffee -seq test.fas -method psicoffee_msa
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That's the problem, it is there and I added the path to the $PATH
:
$ ls -lh /opt/t_coffee/bin/t_coffee
-rwxr-xr-x 1 root root 3.0M Jul 8 2023 /opt/t_coffee/bin/t_coffee
$ echo $PATH
/loads_of_other_paths:/opt/t_coffee/bin
$ MAX_N_PID_4_TCOFFEE=100000000 /opt/t_coffee/bin/t_coffee test.fas -mode=psicoffee
#*****************************************************************
--ERROR: # [FATAL:T-COFFEE]
# The Program /opt/t_coffee/bin/t_coffee Needed by T-COFFEE Could not be found
# If /opt/t_coffee/bin/t_coffee is installed on your system:
# -Make sure /opt/t_coffee/bin/t_coffee is in your $path:
# If /opt/t_coffee/bin/t_coffee is NOT installed obtain a copy from:
# (null)
#
#
# and install it manualy
******************************************************************
*************************************************************************************************
* FULL TRACE BACK PID: 1615165
1615165 -- ERROR: # [FATAL:T-COFFEE]
1615165 -- COM: /opt/t_coffee/bin/t_coffee test.fas -mode psicoffee
1615165 -- STACK: 1502629 -> 1615165
*************************************************************************************************
# TERMINATION STATUS: FAILURE [PROGRAM: T-COFFEE pid 1615165 ppid 1502629
#CL: /opt/t_coffee/bin/t_coffee test.fas -mode psicoffee
I was originally trying to run it with conda facing the same issues but currently debugging it with the system-wide installation.
This is strange. Could it be other t_coffee versions around? What if you type ‘which t_coffee’ from a new shell
--
Dr Cedric Notredame, PhD ORCID - https://orcid.org/0000-0003-1461-0988https://urldefense.com/v3/__https://orcid.org/0000-0003-1461-0988__;!!D9dNQwwGXtA!SMc4j2BjfVrbtIkNLgH9GMyKYaeMTwLyLZOY3ekmpRVksWfqAb3vYibX4HPTOmrkgdLvI8sL7E0LUiwBHJhlxDvKNUIvshE$
On 17 Jul 2024, at 14:21, Andrey Rozenberg @.***> wrote:
That's the problem, it is there and I added the path to the $PATH:
$ ls -lh /opt/t_coffee/bin/t_coffee -rwxr-xr-x 1 root root 3.0M Jul 8 2023 /opt/t_coffee/bin/t_coffee $ echo $PATH /loads_of_other_paths:/opt/t_coffee/bin $ MAX_N_PID_4_TCOFFEE=100000000 /opt/t_coffee/bin/t_coffee test.fas -mode=psicoffee
--ERROR: # [FATAL:T-COFFEE]
# #
I was originally trying to run it with conda facing the same issues but currently debugging it with the system-wide installation.
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$ which t_coffee
/usr/local/bin/t_coffee
$ cat /usr/local/bin/t_coffee
dir=/opt/t_coffee
MAX_N_PID_4_TCOFFEE=4194304 PLUGINS_4_TCOFFEE="$dir/plugins/linux" "$dir/bin/t_coffee" "$@"
$ ls -lh /opt/t_coffee
total 4.2M
drwxr-xr-x 3 root root 4.0K Jul 17 15:34 bin
drwxr-xr-x 2 root root 4.0K Jul 17 15:34 lck
drwxrwxrwx 2 root root 4.0K Jul 17 15:34 mcoffee
drwxrwxrwx 2 root root 4.0K Jul 17 15:34 methods
drwxr-xr-x 5 root root 4.0K Jul 17 15:34 perl
drwxrwxrwx 3 root root 4.0K Jul 17 15:34 plugins
drwxr-xr-x 10 root root 4.0K Jul 17 15:34 src
drwxr-xr-x 2 root root 4.0K Jul 17 15:34 tmp
-rwx------ 1 root root 4.1M Jul 17 15:34 uninstall
-rw-r--r-- 1 root root 11K Jul 17 15:34 uninstall.dat
$ ls -lh /opt/t_coffee/bin/
total 3.0M
drwxr-xr-x 2 root root 4.0K Jul 17 15:34 linux
-rwxr-xr-x 1 root root 3.0M Jul 8 2023 t_coffee
From a conda environment the error is the same:
#*****************************************************************
--ERROR: # [FATAL:T-COFFEE]
# The Program /path_to_conda_env/libexec/t-coffee-13.46.0.919e8c6b-0/bin/linux/t_coffee Needed by T-COFFEE Could not be found
# If /path_to_conda_env/libexec/t-coffee-13.46.0.919e8c6b-0/bin/linux/t_coffee is installed on your system:
# -Make sure /path_to_conda_env/libexec/t-coffee-13.46.0.919e8c6b-0/bin/linux/t_coffee is in your $path:
# If /path_to_conda_env/libexec/t-coffee-13.46.0.919e8c6b-0/bin/linux/t_coffee is NOT installed obtain a copy from:
# (null)
#
#
# and install it manualy
******************************************************************
*************************************************************************************************
* FULL TRACE BACK PID: 1623734
1623734 -- ERROR: # [FATAL:T-COFFEE]
1623734 -- COM: /path_to_conda_env/libexec/t-coffee-13.46.0.919e8c6b-0/bin/linux/t_coffee test.fas -mode psicoffee
1623734 -- STACK: 1623730 -> 1623734
*************************************************************************************************
# TERMINATION STATUS: FAILURE [PROGRAM: T-COFFEE pid 1623734 ppid 1623730
#CL: /path_to_conda_env/libexec/t-coffee-13.46.0.919e8c6b-0/bin/linux/t_coffee test.fas -mode psicoffee
Interesting, on a different linux machine with v. 13.39.0.d675aed installed in user's /home it does seem to work.
Thanks Andrey. This looks like some kind of install issue. Do you have anyway to make a fresh install ? We will try to reproduce the issue on our side.
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On 17 Jul 2024, at 14:43, Andrey Rozenberg @.***> wrote:
Interesting, on a different linux machine with v. 13.39.0.d675aed installed in user's /home it does seem to work.
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Yeah, Cedric it does seem to be related to installation. I've tried now to install v. 13.46 in three different ways:
/opt/t_coffee
- psicoffee fails~/.t_coffee
- worksOn the second server I was in fact already having 13.46. I've checked that the differences between the three installation strategies are reproducible on both servers.
I'm ready to help with further debugging.
Thanks for the feedback @alephreish! 😄 I made a test in a Linux machine where t_coffee has never been installed before:
Using the installer here
In this case after sourcing the updated .bashrc
I get rid of the error.
Directly from the tarball here
In this case, I added t_coffee
to my path and it worked:
./T-COFFEE_installer_Version_13.46.0.919e8c6b_linux_x64/bin/t_coffee test.fas -mode psicoffee
--ERROR: # [FATAL:T-COFFEE]
# #
$ which t_coffee
$ export PATH="/home/jespinosa/DELETE_ME/tcoffee_i_66/T-COFFEE_installer_Version_13.46.0.919e8c6b_linux_x64/bin:$PATH" (base) jespinosa@pardal:tcoffee_i_66$ which t_coffee /home/jespinosa/DELETE_ME/tcoffee_i_66/T-COFFEE_installer_Version_13.46.0.919e8c6b_linux_x64/bin/t_coffee
$ t_coffee test.fas -mode psicoffee
PROGRAM: T-COFFEE Version_13.46.0.919e8c6b (2023-07-07 22:06:42 - Revision 29996c5 - Build 980) -full_log S [0] -genepred_score S [0] nsd -run_name S [0] -mem_mode S [0] mem -extend D [1] 1 -extend_mode S [0] very_fast_triplet -max_n_pair D [0] 10 -seq_name_for_quadruplet S [0] all -compact S [0] default -clean S [0] no -do_self FL [0] 0 -do_normalise D [0] 1000 -template_file S [1] BLAST -template_dirE S [0] ./ -setenv S [0] 0 -export S [0] 0 -template_mode S [0] -flip D [0] 0 -remove_template_file D [0] 0 -profile_template_file S [0] -in S [1] Mproba_pair -seq S [1] test.fas -aln S [0] -method_limits S [0] -method S [0] -lib S [0] -profile S [0] -profile1 S [0] -profile2 S [0] -pdb S [0] -relax_lib D [0] 1 -filter_lib D [0] 0 -shrink_lib D [0] 0 -out_lib W_F [0] no -out_lib_mode S [0] primary -lib_only D [0] 0 -outseqweight W_F [0] no -seq_source S [0] ANY -cosmetic_penalty D [0] 0 -gapopen D [0] 0 -gapext D [0] 0 -fgapopen D [0] 0 -fgapext D [0] 0 -nomatch D [0] 0 -newtree W_F [0] default -tree W_F [0] NO -usetree R_F [0] -tree_mode S [0] nj -distance_matrix_mode S [0] ktup -distance_matrix_sim_mode S [0] idmat_sim1 -quicktree FL [0] 0 -outfile W_F [0] default -maximise FL [1] 1 -output S [0] aln html -len D [0] 0 -infile R_F [0] -matrix S [0] default -fs_matrix S [0] idmat -fs_gop D [0] 1 -fs_gep D [0] 1 -tg_mode D [0] 1 -profile_mode S [0] cw_profile_profile -profile_comparison S [0] profile -dp_mode S [0] linked_pair_wise -ktuple D [0] 1 -ndiag D [0] 0 -diag_threshold D [0] 0 -diag_mode D [0] 0 -sim_matrix S [0] vasiliky -transform S [0] -extend_seq FL [0] 0 -outorder S [0] input -inorder S [0] aligned -seqnos S [0] off -case S [0] keep -cpu D [0] 0 -ulimit D [0] -1 -maxnseq D [0] -1 -maxlen D [0] -1 -sample_dp D [0] 0 -weight S [0] default -seq_weight S [0] no -align FL [1] 1 -mocca FL [0] 0 -domain FL [0] 0 -start D [0] 0 -len D [0] 0 -scale D [0] 0 -mocca_interactive FL [0] 0 -method_evaluate_mode S [0] default -color_mode S [0] new -aln_line_length D [0] 0 -evaluate_mode S [0] triplet -get_type FL [0] 0 -clean_aln D [0] 0 -clean_threshold D [1] 1 -clean_iteration D [1] 1 -clean_evaluate_mode S [0] t_coffee_fast -extend_matrix FL [0] 0 -prot_min_sim D [0] 0 -prot_max_sim D [100] 100 -psiJ D [0] 3 -psitrim_mode S [0] regtrim -psitrim_tree S [0] codnd -psitrim D [100] 100 -prot_min_cov D [90] 90 -pdb_type S [0] d -pdb_min_sim D [35] 35 -pdb_max_sim D [100] 100 -pdb_min_cov D [50] 50 -pdb_blast_server W_F [0] EBI -blast W_F [0] -blast_server W_F [0] EBI -pdb_db W_F [0] pdb -protein_db W_F [0] uniref50 -method_log W_F [0] no -struc_to_use S [0] -cache W_F [0] use -print_cache FL [0] 0 -align_pdb_param_file W_F [0] no -align_pdb_hasch_mode W_F [0] hasch_ca_trace_bubble -external_aligner S [0] NO -msa_mode S [0] tree -et_mode S [0] et -master S [0] no -blast_nseq D [0] 0 -lalign_n_top D [0] 10 -iterate D [0] 0 -trim D [0] 0 -split D [0] 0 -trimfile S [0] default -split D [0] 0 -split_nseq_thres D [0] 0 -split_score_thres D [0] 0 -check_pdb_status D [0] 0 -clean_seq_name D [0] 0 -seq_to_keep S [0] -dpa_master_aln S [0] -dpa_maxnseq D [0] 0 -dpa_min_score1 D [0] -dpa_min_score2 D [0] -dpa_keep_tmpfile FL [0] 0 -dpa_debug D [0] 0 -multi_core S [0] templates_jobs_relax_msa_evaluate -n_core D [0] 1 -thread D [0] 1 -max_n_proc D [0] 1 -lib_list S [0] -prune_lib_mode S [0] 5 -tip S [0] none -rna_lib S [0] -no_warning D [0] 0 -run_local_script D [0] 0 -proxy S [0] unset -email S [0] -clean_overaln D [0] 0 -overaln_param S [0] -overaln_mode S [0] -overaln_model S [0] -overaln_threshold D [0] 0 -overaln_target D [0] 0 -overaln_P1 D [0] 0 -overaln_P2 D [0] 0 -overaln_P3 D [0] 0 -overaln_P4 D [0] 0 -exon_boundaries S [0] -display D [0] 100
INPUT FILES Input File (M) proba_pair Input File (S) test.fas Format fasta_seq
Identify Master Sequences [no]:
Master Sequences Identified Looking For Sequence Templates:
Template Type: [BLAST] Mode Or File: [BLAST] [Start
18227 -- WARNING: Could Not Use EMAIL
pid 18201 -- Could not Run t_coffee -other_pg tc_generic_method.pl -mode=profile_template -database=uniref50 -method=blastp -cache=/home/jespinosa/.t_coffee//cache/ -minid=0 -maxid=100 -mincov=90 -trim=100 -server=EBI -type=R -infile=/var/tmp/tco/tcovn5mqt6q18201//1783118201t517o136 -outfile=test_prf1.template_list -tmpdir=/var/tmp/tco/tcovn5mqt6q18201/ to find templates[T-COFFEE](unforked mode) ] pid 18201 -- Impossible to find BLAST Templates Check that your blast server is properly installed [See documentation][FATAL:T-COFFEE]
So as @cnotred mentioned, you may have a conflicting installation.
Hi @JoseEspinosa, no, it's not due to conflicting installation.
It's due to environmental variables:
$ conda activate t_coffee_env
(t_coffee_env) $ env | grep COFFEE
# nothing
For the system-wide installation the environmental variables have to be fixed manually. For the conda-based installation I'd call this a bug. A workaround for conda:
export DIR_4_TCOFFEE=($CONDA_PREFIX/libexec/t-coffee-*)
export PERL5LIB=($CONDA_PREFIX/lib/5.*)
export PLUGINS_4_TCOFFEE=$DIR_4_TCOFFEE/plugins/linux
export PATH=$DIR_4_TCOFFEE/bin/linux:$PATH
export MAX_N_PID_4_TCOFFEE=4194304
I'm closing this as installation in /home
is the default for t_coffee
, so anyone installing it system-wide should read the readme better and take care of the system variables themselves. The issue with the conda
should be addressed in bioconda
.
I'm closing this as installation in
/home
is the default fort_coffee
, so anyone installing it system-wide should read the readme better and take care of the system variables themselves. The issue with theconda
should be addressed inbioconda
.
OK, thanks for reporting!
I cannot make t_coffee run psicoffee. See a minimal example below. Also, not sure if it uses blast+ or legacy blast - which one should I use to create a local database?