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Merge pull request #104636 from rmcgibbo/inchi

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inchi: init at 1.05
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markuskowa 2020-12-08 22:57:36 +01:00 committed by GitHub
parent 1fb6bb9791 35bab12ed0
commit 7ad97abae7
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2 changed files with 53 additions and 0 deletions
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51
pkgs/development/libraries/inchi/default.nix Normal file
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@ -0,0 +1,51 @@
{ pkgs, fetchurl, stdenv, unzip }:
stdenv.mkDerivation {
pname = "inchi";
version = "1.05";
src = fetchurl {
url = "http://www.inchi-trust.org/download/105/INCHI-1-SRC.zip";
sha1 = "e3872a46d58cb321a98f4fd4b93a989fb6920b9c";
};
nativeBuildInputs = [ pkgs.unzip ];
outputs = [ "out" "doc" ];
enableParallelBuilding = true;
preBuild = ''
cd ./INCHI_API/libinchi/gcc
'';
installPhase = ''
cd ../../..
mkdir -p $out/lib
mkdir -p $out/include/inchi
mkdir -p $doc/share/
install -m 755 INCHI_API/bin/Linux/libinchi.so.1.05.00 $out/lib
ln -s $out/lib/libinchi.so.1.05.00 $out/lib/libinchi.so.1
ln -s $out/lib/libinchi.so.1.05.00 $out/lib/libinchi.so
install -m 644 INCHI_BASE/src/*.h $out/include/inchi
runHook postInstall
'';
postInstall =
let
src-doc = fetchurl {
url = "http://www.inchi-trust.org/download/105/INCHI-1-DOC.zip";
sha1 = "2f54y0san34v01c215kk0cigzsn76js5";
};
in
''
unzip '${src-doc}'
install -m 644 INCHI-1-DOC/*.pdf $doc/share
'';
meta = with stdenv.lib; {
homepage = "https://www.inchi-trust.org/";
description = "IUPAC International Chemical Identifier library";
license = licenses.lgpl2Plus;
platforms = platforms.all;
maintainers = with maintainers; [ rmcgibbo ];
};
}

2
pkgs/top-level/all-packages.nix
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@ -2312,6 +2312,8 @@ in
icdiff = callPackage ../tools/text/icdiff {};
inchi = callPackage ../development/libraries/inchi {};
ifm = callPackage ../tools/graphics/ifm {};
ink = callPackage ../tools/misc/ink { };