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gnu: openbabel: Update to 3.1.1.

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* gnu/packages/chemistry.scm (openbabel): Update to 3.1.1.
[source]: Update URI.
[arguments]: Temporarily skip tests on i686-linux.
This commit is contained in:
Kei Kebreau 2021-01-26 00:38:25 -05:00
parent 35bb3d5ffd
commit 1f1c525ac9
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1 changed files with 11 additions and 7 deletions
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18
gnu/packages/chemistry.scm
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@ -522,19 +522,23 @@ usual algorithms you expect from a modern molecular dynamics implementation.")
(define-public openbabel (define-public openbabel
(package (package
(name "openbabel") (name "openbabel")
(version "2.4.1") (version "3.1.1")
(source (origin (source (origin
(method url-fetch) (method url-fetch)
(uri (string-append "mirror://sourceforge/" name "/" name "/" (uri (string-append "https://github.com/openbabel/openbabel/"
version "/" name "-" version ".tar.gz")) "releases/download/openbabel-"
(string-replace-substring version "." "-")
"/openbabel-" version "-source.tar.bz2"))
(sha256 (sha256
(base32 (base32
"1z3d6xm70dpfikhwdnbzc66j2l49vq105ch041wivrfz5ic3ch90")) "0s0f4zib8vshfaywsr5bjjz55jwsg6yiz2qw4i5jm8wysn0q7v56"))))
(patches
(search-patches "openbabel-fix-crash-on-nwchem-output.patch"))))
(build-system cmake-build-system) (build-system cmake-build-system)
(arguments (arguments
`(#:configure-flags `(;; FIXME: Disable tests on i686 to work around
;; https://github.com/openbabel/openbabel/issues/2041.
#:tests? ,(or (%current-target-system)
(not (string=? "i686-linux" (%current-system))))
#:configure-flags
(list "-DOPENBABEL_USE_SYSTEM_INCHI=ON" (list "-DOPENBABEL_USE_SYSTEM_INCHI=ON"
(string-append "-DINCHI_LIBRARY=" (string-append "-DINCHI_LIBRARY="
(assoc-ref %build-inputs "inchi") (assoc-ref %build-inputs "inchi")