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Edoardo SARTI
profileview
Commits
d56145c8
Commit
d56145c8
authored
Jun 28, 2019
by
Riccardo Vicedomini
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added (hidden) parameters to change hhblits arguments
parent
fe4b2667
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29 additions
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3 deletions
+29
-3
profileview-build
profileview-build
+29
-3
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profileview-build
View file @
d56145c8
...
@@ -25,6 +25,12 @@ trap ctrl_c INT; function ctrl_c() { exit 5; }
...
@@ -25,6 +25,12 @@ trap ctrl_c INT; function ctrl_c() { exit 5; }
# Definition of functions and global variables specific to this script
# Definition of functions and global variables specific to this script
HHBLITS_ARG_COV
=
70
HHBLITS_ARG_QID
=
60
HHBLITS_ARG_MAXID
=
98
HHBLITS_ARG_ITER
=
3
HHBLITS_ARG_EVALUE
=
1e-10
PVLIB_FORCE
=
false
PVLIB_FORCE
=
false
PVLIB_PATH
=
""
PVLIB_PATH
=
""
PVLIB_DOMID
=
""
PVLIB_DOMID
=
""
...
@@ -60,7 +66,7 @@ function print_usage() {
...
@@ -60,7 +66,7 @@ function print_usage() {
# retrieve provided arguments
# retrieve provided arguments
opts
=
"i:D:d:n:t:j:hV"
opts
=
"i:D:d:n:t:j:hV"
longopts
=
"input:,domain-id:,db:,lib-name:,force,threads:,max-jobs:,help,version"
longopts
=
"input:,domain-id:,db:,lib-name:,force,threads:,max-jobs:,help,version
,cov:,qid:,max-id:,evalue:,iter:
"
ARGS
=
$(
getopt
-o
"
${
opts
}
"
-l
"
${
longopts
}
"
-n
"
${
CMD_NAME
}
"
--
"
${
@
}
"
)
ARGS
=
$(
getopt
-o
"
${
opts
}
"
-l
"
${
longopts
}
"
-n
"
${
CMD_NAME
}
"
--
"
${
@
}
"
)
if
[
$?
-ne
0
]
||
[
$#
-eq
0
]
;
then
# do not change the order of this test!
if
[
$?
-ne
0
]
||
[
$#
-eq
0
]
;
then
# do not change the order of this test!
print_usage
print_usage
...
@@ -106,6 +112,26 @@ while [ -n "${1}" ]; do
...
@@ -106,6 +112,26 @@ while [ -n "${1}" ]; do
print_version
print_version
exit
0
exit
0
;;
;;
--cov
)
shift
HHBLITS_ARG_COV
=
${
1
}
;;
--qid
)
shift
HHBLITS_ARG_QID
=
${
1
}
;;
--max-id
)
shift
HHBLITS_ARG_MAXID
=
${
1
}
;;
--evalue
)
shift
HHBLITS_ARG_EVALUE
=
${
1
}
;;
--iter
)
shift
HHBLITS_ARG_ITER
=
${
1
}
;;
--
)
--
)
shift
shift
break
break
...
@@ -193,7 +219,7 @@ for query in "${PVLIB_QUERY}"/*.fa; do
...
@@ -193,7 +219,7 @@ for query in "${PVLIB_QUERY}"/*.fa; do
[
-e
"
${
query
}
"
]
||
continue
[
-e
"
${
query
}
"
]
||
continue
queryBase
=
${
query
##*/
}
queryBase
=
${
query
##*/
}
queryName
=
${
queryBase
%.fa
}
queryName
=
${
queryBase
%.fa
}
echo
"hhblits
${
HHBLITS_DBS
}
-i
${
query
}
-o stdout -oa3m
${
PVLIB_PREFIX
}
/a3m/
${
queryName
}
.a3m -ohhm
${
PVLIB_PREFIX
}
/hhm/
${
queryName
}
.hhm -M first -
qid 60 -cov 70 -id 98 -e 1e-10 -n 2
-cpu
${
NTHREADS
}
-v 0 >/dev/null 2>&1"
echo
"hhblits
${
HHBLITS_DBS
}
-i
${
query
}
-o stdout -oa3m
${
PVLIB_PREFIX
}
/a3m/
${
queryName
}
.a3m -ohhm
${
PVLIB_PREFIX
}
/hhm/
${
queryName
}
.hhm -M first -
cov
${
HHBLITS_ARG_COV
}
-qid
${
HHBLITS_ARG_QID
}
-id
${
HHBLITS_ARG_MAXID
}
-e
${
HHBLITS_ARG_EVALUE
}
-n
${
HHBLITS_ARG_ITER
}
-cpu
${
NTHREADS
}
-v 0 >/dev/null 2>&1"
done
|
${
PEXEC_CMD
}
# left it unquoted!
done
|
${
PEXEC_CMD
}
# left it unquoted!
print_status
"formatting a3m files"
print_status
"formatting a3m files"
...
@@ -220,7 +246,7 @@ print_status "generating ProfileView library data"
...
@@ -220,7 +246,7 @@ print_status "generating ProfileView library data"
for
hmm
in
"
${
PVLIB_DIR
}
"
/hmm/
*
.hmm
;
do
for
hmm
in
"
${
PVLIB_DIR
}
"
/hmm/
*
.hmm
;
do
[
-e
"
${
hmm
}
"
]
||
continue
[
-e
"
${
hmm
}
"
]
||
continue
awk
-v
domId
=
"
${
PVLIB_DOMID
}
"
'$1~/^NAME$/{hmm_name=$2;next} $1~/^LENG$/{hmm_len=$2;next} $1~/^NSEQ$/{hmm_nseq=$2;next} $1~/^HMM$/{ OFS=","; print hmm_name,domId,hmm_nseq,hmm_len }'
${
hmm
}
awk
-v
domId
=
"
${
PVLIB_DOMID
}
"
'$1~/^NAME$/{hmm_name=$2;next} $1~/^LENG$/{hmm_len=$2;next} $1~/^NSEQ$/{hmm_nseq=$2;next} $1~/^HMM$/{ OFS=","; print hmm_name,domId,hmm_nseq,hmm_len }'
${
hmm
}
done
>
"
${
PVLIB_PREFIX
}
"
/
"
${
PVLIB_NAME
}
"
.models.list
done
>
"
${
PVLIB_PREFIX
}
/
${
PVLIB_NAME
}
.models.list"
python3
"
${
SCRIPTS_DIR
}
"
/createHHdict.py
--hhm-dir
"
${
PVLIB_DIR
}
/hhm"
--prefix
"
${
PVLIB_DIR
}
"
/
${
PVLIB_NAME
}
.hhdict
>
/dev/null 2>&1
python3
"
${
SCRIPTS_DIR
}
"
/createHHdict.py
--hhm-dir
"
${
PVLIB_DIR
}
/hhm"
--prefix
"
${
PVLIB_DIR
}
"
/
${
PVLIB_NAME
}
.hhdict
>
/dev/null 2>&1
python3
"
${
SCRIPTS_DIR
}
"
/createHmmerDict.py
--hmm-dir
"
${
PVLIB_DIR
}
/hmm"
--prefix
"
${
PVLIB_DIR
}
"
/
${
PVLIB_NAME
}
.hmmdict
>
/dev/null 2>&1
python3
"
${
SCRIPTS_DIR
}
"
/createHmmerDict.py
--hmm-dir
"
${
PVLIB_DIR
}
/hmm"
--prefix
"
${
PVLIB_DIR
}
"
/
${
PVLIB_NAME
}
.hmmdict
>
/dev/null 2>&1
...
...
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