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authorEfraim Flashner2021-09-17 12:25:34 +0300
committerPjotr Prins2022-12-11 17:15:46 +0000
commit7c0d24a788dcbe7f8c8efda3d830ae265311fc6d (patch)
tree419cb8f4e677ac7958a5df238a87944836aa6d01 /gn
parent697a66bf0e897a101e8e3cefbaf250491039fe93 (diff)
downloadguix-bioinformatics-7c0d24a788dcbe7f8c8efda3d830ae265311fc6d.tar.gz
Backport direct.so
Diffstat (limited to 'gn')
-rw-r--r--gn/packages/genenetwork.scm1
-rw-r--r--gn/packages/python24.scm122
-rw-r--r--gn/past/genenetwork1.scm289
3 files changed, 412 insertions, 0 deletions
diff --git a/gn/packages/genenetwork.scm b/gn/packages/genenetwork.scm
index 0db7032..b60bd60 100644
--- a/gn/packages/genenetwork.scm
+++ b/gn/packages/genenetwork.scm
@@ -713,6 +713,7 @@ written in C")
       (propagated-inputs
        `(("python" ,python-2.4)
          ("httpd-with-mod-python" ,httpd22-with-mod-python)
+	 ("python-direct" ,python24-direct-gn)
          ("python-htmlgen-GN1" ,python24-htmlgen-GN1)
          ("python-json-GN1" ,python24-json-GN1)
          ("python-mysqlclient" ,python24-mysqlclient)
diff --git a/gn/packages/python24.scm b/gn/packages/python24.scm
index cde8a02..4a26e1f 100644
--- a/gn/packages/python24.scm
+++ b/gn/packages/python24.scm
@@ -4,12 +4,18 @@
   #:use-module (guix packages)
   #:use-module (guix download)
   #:use-module (guix git-download)
+  #:use-module (guix build-system copy)
   #:use-module (guix build-system python)
   #:use-module (gn packages databases)
   #:use-module (gn packages python)
   #:use-module (past packages python)
   #:use-module (gnu packages compression)
   #:use-module (gnu packages databases)
+<<<<<<< HEAD
+=======
+  #:use-module (gnu packages elf)
+  #:use-module (gnu packages gcc)
+>>>>>>> 0684b02... gn: Use known good binary version of direct.so for genenetwork1
   #:use-module (gnu packages maths)
   #:use-module (gnu packages python-xyz)
   #:use-module (gnu packages tls)
@@ -385,3 +391,119 @@ for Python.  The design goals are:
 @item Compatibility with MySQL-3.23 and later
 @end itemize")
     (license license:gpl2+)))
+
+;; It seems this isn't the correct DIRECT binary
+(define-public python24-direct
+  (package
+    (name "python24-direct")
+    (version "1.0.1")
+    (source
+      (origin
+        (method url-fetch)
+        (uri (pypi-uri "DIRECT" version))
+        (sha256
+         (base32
+          "1d4cf9hynlr42hq0k8w7j4qi45rkrgil332sh0hymklxgmyi21h5"))
+        (modules '((guix build utils)))
+        (snippet
+         '(begin
+            ;; Files are autogenerated using f2py.
+            (delete-file "src/direct-f2pywrappers.f")
+            (delete-file "src/directmodule.c")
+            #t))))
+    (build-system python-build-system)
+    (arguments
+     `(#:python ,python-2.4
+       #:phases
+       (modify-phases %standard-phases
+         (add-after 'unpack 'patch-source
+           (lambda _
+             (substitute* "DIRECT/__init__.py"
+               (("\\.direct") "direct"))
+             #t))
+         (replace 'check
+           (lambda* (#:key tests? inputs outputs #:allow-other-keys)
+             (when tests?
+               (add-installed-pythonpath inputs outputs)
+               (with-directory-excursion "test"
+                 (invoke "python" "test_direct.py")))
+             #t))
+         (add-after 'install 'copy-library
+           (lambda* (#:key outputs #:allow-other-keys)
+             (with-directory-excursion
+               (string-append (assoc-ref outputs "out")
+                              "/lib/python2.4/site-packages")
+               (copy-file "DIRECT/direct.so" "direct.so"))
+             #t))
+         (replace 'install-license-files
+           (lambda* (#:key outputs #:allow-other-keys)
+             (install-file "COPYRIGHT"
+                           (string-append (assoc-ref outputs "out")
+                                          "/share/doc/" ,name "-" ,version))
+             #t)))))
+    (propagated-inputs
+     `(("python24-numpy" ,python24-numpy-1.2)))
+    (inputs
+     `(("gfortran" ,gfortran)))
+    (native-inputs
+     `(("python24-nose" ,python24-nose)
+       ("python24-setuptools" ,python24-setuptools)))
+    ;; Also seems to be here: https://github.com/amitibo/pydirect
+    (home-page "http://code.google.com/p/pydirect/")
+    (synopsis "Python wrapper to the DIRECT algorithm")
+    (description
+     "DIRECT is a method to solve global bound constraint optimization problems
+and was originally developed by D. R. Jones, C. D. Perttunen and B. E. Stuckmann.
+@code{pydirect} is a python wrapper around DIRECT.  It enables using DIRECT from
+the comfort of the great Python scripting language.
+The @code{pydirect} package uses the fortan implementation of DIRECT written by
+Joerg.M.Gablonsky, DIRECT Version 2.0.4.  More information on the DIRECT
+algorithm can be found in Gablonsky's
+@url{http://repository.lib.ncsu.edu/ir/bitstream/1840.16/3920/1/etd.pdf,
+thesis}.")
+    (license license:expat)))
+
+; env IPFS_PATH=/export/ipfs/ ipfs add direct.so
+; added QmYUZiuAP6DJeubu69JqvRWSsn53qCZCS3FkRWgTowtWkA direct.so
+; penguin2:~/tmp$ env IPFS_PATH=/export/ipfs/ ipfs pin add QmYUZiuAP6DJeubu69JqvRWSsn53qCZCS3FkRWgTowtWkA
+; pinned QmYUZiuAP6DJeubu69JqvRWSsn53qCZCS3FkRWgTowtWkA recursively
+
+(define-public python24-direct-gn
+  (package
+    (name "python24-direct-gn")
+    (version "GN")
+    (source (origin
+              (method url-fetch)
+              (uri "http://ipfs.genenetwork.org/ipfs/QmYUZiuAP6DJeubu69JqvRWSsn53qCZCS3FkRWgTowtWkA")
+              (file-name "direct.so")
+              (sha256
+               (base32
+                "0kj11dbi25k0wvyxxsylx7dsc7wm7rja799fymklkdd8h561la4i"))))
+    (build-system copy-build-system)
+    (arguments
+     `(#:install-plan
+       '(("direct.so" "lib/python2.4/site-packages/"))
+       #:phases
+       (modify-phases %standard-phases
+         (replace 'unpack
+           (lambda* (#:key inputs #:allow-other-keys)
+             (copy-file (assoc-ref inputs "source") "direct.so")
+             #t))
+         (add-after 'unpack 'patchelf
+           (lambda* (#:key inputs #:allow-other-keys)
+             ;; Writable so we can use patchelf, executable so it is useful.
+             ;; After installation the writable bit is stripped off.
+             (chmod "direct.so" #o777)
+             (invoke "patchelf"
+                     "--set-rpath"
+                     (string-append (assoc-ref inputs "gcc:lib") "/lib")
+                     "direct.so")
+             #t)))))
+    (inputs
+     `(("gcc:lib" ,gcc "lib")))
+    (native-inputs
+     `(("patchelf" ,patchelf)))
+    (home-page "")
+    (synopsis "")
+    (description "")
+    (license #f)))
diff --git a/gn/past/genenetwork1.scm b/gn/past/genenetwork1.scm
new file mode 100644
index 0000000..c557ee7
--- /dev/null
+++ b/gn/past/genenetwork1.scm
@@ -0,0 +1,289 @@
+;; Bioinformatics module
+
+(define-module (gn past genenetwork1)
+  #:use-module ((guix licenses) #:prefix license:)
+  #:use-module (guix packages)
+  #:use-module (guix utils)
+  #:use-module (guix download)
+  #:use-module (guix git-download)
+  #:use-module (guix build-system cargo)
+  #:use-module (guix build-system gnu)
+  #:use-module (guix build-system python)
+  #:use-module (guix build-system trivial)
+  #:use-module (guix graph)
+  #:use-module (guix scripts graph)
+  #:use-module (guix store)
+  #:use-module (guix gexp)
+  #:use-module (gnu packages)
+  #:use-module (gnu packages base)
+  #:use-module (gnu packages bioconductor)
+  #:use-module (gnu packages bioinformatics)
+  #:use-module (gnu packages bootstrap)
+  #:use-module (gnu packages check)
+  #:use-module (gnu packages cran)
+  #:use-module (gnu packages crates-io)
+  #:use-module (gnu packages compression)
+  #:use-module (gnu packages databases)
+  #:use-module (gnu packages ghostscript)
+  #:use-module (gnu packages graphviz)
+  #:use-module (gnu packages parallel)
+  #:use-module (gnu packages python)
+  #:use-module (gnu packages python-check)
+  #:use-module (gnu packages python-crypto)
+  #:use-module (gnu packages python-science)
+  #:use-module (gnu packages python-web)
+  #:use-module (gnu packages python-xyz)
+  #:use-module (gnu packages rdf)
+  #:use-module (gnu packages scheme)
+  #:use-module (gnu packages statistics)
+  #:use-module (gnu packages version-control)
+  #:use-module (gnu packages vim)
+  #:use-module (gnu packages web)
+  #:use-module (gnu packages wget)
+  #:use-module (gnu packages xml)
+  #:use-module (past packages python)
+  #:use-module (past packages web)
+  #:use-module (gn packages bioinformatics)
+  #:use-module (gn packages twint)
+  #:use-module (gn packages databases)
+  #:use-module (gn packages elixir)
+  #:use-module (gn packages gemma)
+  #:use-module (gn packages javascript)
+  #:use-module (gn packages phewas)
+  #:use-module (gn packages python)
+  #:use-module (gn packages python24)
+  #:use-module (gn packages statistics)
+  #:use-module (gn packages web)
+  #:use-module (srfi srfi-1))
+
+
+(define-public python2-qtlreaper
+  (let ((commit "442c217b90393380a8634ff8636b44992f5c53dd"))
+  (package
+    (name "python2-qtlreaper")
+    (version (string-append "1.11-gn2-" (string-take commit 7) ))
+    (source (origin
+             (method git-fetch)
+             (uri (git-reference
+                   ;; (url "https://github.com/genenetwork/genenetwork2.git")
+                   (url "https://github.com/pjotrp/QTLreaper.git")
+                   (commit commit)))
+             (file-name (string-append name "-" (string-take commit 7)))
+             (sha256
+              (base32
+               "1rrbm1ap2zzyjxmrs9aa1d18sgiba5dhj1fmkl7wmab06jv3j1hm"))))
+    (build-system python-build-system)
+    (arguments
+     `(#:python ,python-2
+       #:tests? #f))   ; no 'setup.py test' really!
+    (home-page "http://qtlreaper.sourceforge.net/")
+    (synopsis "Scan expression data for QTLs")
+    (description
+     "Batch-oriented version of WebQTL. It requires, as input,
+expression data from members of a set of recombinant inbred lines and
+genotype information for the same lines.  It searches for an
+association between each expression trait and all genotypes and
+evaluates that association by a permutation test.  For the permutation
+test, it performs only as many permutations as are necessary to define
+the empirical P-value to a reasonable precision. It also performs
+bootstrap resampling to estimate the confidence region for the
+location of a putative QTL.")
+    (license license:gpl2+))))
+
+(define-public python24-qtlreaper
+  (let ((commit "442c217b90393380a8634ff8636b44992f5c53dd"))
+    (package
+      (name "python24-qtlreaper")
+      (version (git-version "1.11" "gn1" commit))
+      (source (origin
+                (method git-fetch)
+                (uri (git-reference
+                       ;; (url "https://github.com/genenetwork/genenetwork2.git")
+                       (url "https://github.com/pjotrp/QTLreaper.git")
+                       (commit commit)))
+                (file-name (git-file-name name version))
+                (sha256
+                 (base32
+                  "1rrbm1ap2zzyjxmrs9aa1d18sgiba5dhj1fmkl7wmab06jv3j1hm"))))
+      (build-system python-build-system)
+      (arguments
+       `(#:python ,python-2.4
+         #:phases
+         (modify-phases %standard-phases
+           (add-after 'unpack 'make-max-markername-size-larger
+             (lambda _
+               (substitute* "Src/dataset.c"
+                 (("512") "2048"))
+               #t))
+           (replace 'check
+             (lambda* (#:key inputs outputs #:allow-other-keys)
+               (add-installed-pythonpath inputs outputs)
+               (invoke "python" "test/runtest.py"))))))
+      (native-inputs
+       `(("python24-setuptools" ,python24-setuptools)))
+      (home-page "http://qtlreaper.sourceforge.net/")
+      (synopsis "Scan expression data for QTLs")
+      (description
+       "Batch-oriented version of WebQTL. It requires, as input,
+expression data from members of a set of recombinant inbred lines and
+genotype information for the same lines.  It searches for an
+association between each expression trait and all genotypes and
+evaluates that association by a permutation test.  For the permutation
+test, it performs only as many permutations as are necessary to define
+the empirical P-value to a reasonable precision. It also performs
+bootstrap resampling to estimate the confidence region for the
+location of a putative QTL.")
+      (license license:gpl2+))))
+
+(define-public genenetwork1
+  (let ((commit "acf65ac9ae4be395c07c1629758f7408bf4eab5f") ; June 3, 2020
+        (revision "2"))
+    (package
+      (name "genenetwork1")
+      (version (git-version "0.0.0" revision commit))
+      (source (origin
+        (method git-fetch)
+        (uri (git-reference
+               (url "https://github.com/genenetwork/genenetwork1.git")
+               (commit commit)))
+        (file-name (git-file-name name version))
+        (sha256
+         (base32
+          "0xmmmjyvh80yd8b0cjrwpdmxl8k9zj5ly65r2g9aygx74njsp4fi"))))
+      (build-system gnu-build-system)
+      (native-inputs
+       `(("ghostscript" ,ghostscript)
+         ("graphviz" ,graphviz)
+         ("wget" ,wget)))
+      (propagated-inputs
+       `(("python" ,python-2.4)
+         ("httpd-with-mod-python" ,httpd22-with-mod-python)
+         ("python-direct" ,python24-direct-gn)
+         ("python-htmlgen-GN1" ,python24-htmlgen-GN1)
+         ("python-json-GN1" ,python24-json-GN1)
+         ("python-mysqlclient" ,python24-mysqlclient)
+         ("python-numarray" ,python24-numarray)
+         ("python-piddle" ,python24-piddle)
+         ("python-pp-GN1" ,python24-pp-GN1)
+         ("python-pyx" ,python24-pyx)
+         ("python-pyxlwriter" ,python24-pyxlwriter)
+         ("python-qtlreaper" ,python24-qtlreaper)
+         ("python-rpy2" ,python24-rpy2)
+         ("python-svg-GN1" ,python24-svg-GN1)))
+      (arguments
+       `(#:tests? #f ; no tests
+         #:phases
+         (modify-phases %standard-phases
+           (delete 'configure)
+           (delete 'build)
+           (add-after 'patch-generated-file-shebangs 'patch-more-files
+             (lambda* (#:key inputs #:allow-other-keys)
+               (let ((piddle (assoc-ref inputs "python-piddle")))
+                 (substitute* "web/webqtl/networkGraph/networkGraphUtils.py"
+                   (("/usr/local/bin/neato") (which "neato"))
+                   (("/usr/local/bin/circo") (which "circo"))
+                   (("/usr/local/bin/twopi") (which "twopi"))
+                   (("/usr/local/bin/fdp") (which "fdp"))
+                   (("ps2pdf") (which "ps2pdf")))
+                 (substitute* "web/webqtl/maintainance/addRif.py"
+                   (("rm ") (string-append (which "rm") " "))
+                   (("wget ") (string-append (which "wget") " "))
+                   (("gunzip") (which "gunzip")))
+                 (substitute* "web/webqtl/misc/editHtmlPage.py"
+                   (("/bin/cp") (which "cp")))
+                 (substitute* "web/webqtl/geneWiki/AddGeneRIFPage.py"
+                   (("touch") (which "touch")))
+                 (substitute* '("web/webqtl/maintainance/addRif.py"
+                                "web/webqtl/networkGraph/networkGraphPage.py"
+                                "web/webqtl/utility/svg.py")
+                   (("/usr/bin/(env )?python") (which "python")))
+                 (substitute* "web/webqtl/base/webqtlConfigLocal.py"
+                   (("PythonPath.*")
+                    (string-append "PythonPath = '" (which "python") "'\n"))
+                   (("PIDDLE_FONT_PATH.*/lib")
+                    (string-append "PIDDLE_FONT_PATH = '" piddle "/lib"))))
+               #t))
+           (add-after 'patch-generated-file-shebangs 'changes-for-deployed-service
+             (lambda* (#:key outputs #:allow-other-keys)
+               (let ((out    (assoc-ref outputs "out")))
+                 (substitute* "web/webqtl/base/webqtlConfigLocal.py"
+                   ;; Where GN1 is located: (GNROOT)
+                   (("/gnshare/gn") out)
+                   ;; Where the database is located: (sql_host)
+                   (("tux01.uthsc.edu") "127.0.0.1"))
+                   (substitute* '("web/webqtl/maintainance/QTL_Reaper_cal_lrs.py")
+                     (("128\\.169\\.5\\.59") "localhost"))
+                 ;; This directory (TMPDIR) is expected to be writable by apache.
+                 ;; /tmp is private inside the container.
+                 (symlink "/tmp" "web/tmp")
+                 ;; IMGDIR is expected to be writable.
+                 (symlink "/tmp" "web/image")
+                 (system "chmod 0777 web/tmp")
+                 ;; More writable locations:
+                 (substitute* (list "web/webqtl/collection/ExportSelectionDetailInfoPage.py"
+                                    "web/webqtl/pairScan/DirectPlotPage.py"
+                                    "web/webqtl/updateTrait/DataUpdatePage.py"
+                                    "web/webqtl/utility/Plot.py")
+                   (("/gnshare/gn/web/debug_file.txt") "/tmp/debug_file.txt"))
+                 ;; We mount the genotypes folder (GENODIR) in the OS-config and
+                 ;; provide the symlink to that location from the package.
+                 ;; And now the directory is magically available!
+                 (symlink "/gnshare/gn/web/genotypes" "web/genotypes")
+                 (substitute* "web/webqtl/base/webqtlConfig.py"
+                   (("http://www.genenetwork.org") "http://gn1-test.genenetwork.org"))
+                 ;; Inside the gn1 container, there's some conflict when
+                 ;; importing the user module, therefore, as a hack, rename
+                 ;; user to useralt
+                 (mkdir "web/webqtl/useralt")
+                 (copy-recursively "web/webqtl/user" "web/webqtl/useralt")
+                 (substitute* '("web/webqtl/main.py")
+                   (("from user import") "from useralt import"))
+                 #t)))
+           (add-after 'unpack 'use-local-links
+             (lambda _
+               (substitute* '("web/javascript/menu_items.js"
+                              "web/webqtl/maintainance/updateMenuJS.py")
+                 (("http://(www|gn1).genenetwork.org") ""))
+
+               ;; Move this file out of the way while patching files.
+               (rename-file "web/infoshare/manager/MDB-Free/index.html"
+                            "web/infoshare/manager/MDB-Free/index.htm")
+               (substitute* (cons*
+                              "web/webqtl/base/indexBody.py"
+                              "web/webqtl/submitTrait/BatchSubmitPage.py"
+                              (find-files "web" "\\.html"))
+                 ((".*base href.*") "")
+                 (("(HREF|href)=\\\"http://(www.)?genenetwork.org")
+                  "href=\""))
+               ;; Move this file back to its original location.
+               (rename-file "web/infoshare/manager/MDB-Free/index.htm"
+                            "web/infoshare/manager/MDB-Free/index.html")
+
+               (substitute* (cons*
+                              "web/humanCross.html"
+                              "web/webqtl/base/indexBody.py"
+                              "web/whats_new.html"
+                              (find-files "web/dbdoc" "\\.html"))
+                 (("src=\\\"http://www.genenetwork.org") "src=\""))
+               #t))
+           (replace 'install
+             (lambda* (#:key outputs #:allow-other-keys)
+               (copy-recursively "." (assoc-ref outputs "out"))
+               #t)))))
+      (home-page "http://www.genenetwork.org/webqtl/main.py")
+      (synopsis
+       "Combined database and data analysis software resource for systems genetics")
+      (description "GeneNetwork is a group of linked data sets and tools used to
+study complex networks of genes, molecules, and higher order gene function and
+phenotypes.  GeneNetwork combines more than 25 years of legacy data generated by
+hundreds of scientists together with sequence data (SNPs) and massive
+transcriptome data sets (expression genetic or eQTL data sets).  The
+@dfn{quantitative trait locus} (QTL) mapping module that is built into GN is
+optimized for fast on-line analysis of traits that are controlled by
+combinations of gene
+variants and environmental factors.  GeneNetwork can be used to study humans,
+mice (BXD, AXB, LXS, etc.), rats (HXB), Drosophila, and plant species (barley
+and Arabidopsis).  Most of these population data sets are linked with dense
+genetic maps (genotypes) that can be used to locate the genetic modifiers that
+cause differences in expression and phenotypes, including disease susceptibility.")
+      (license license:agpl3+))))