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Merge pull request #182038 from natsukium/dssp/init
dssp: init at 4.0.5
This commit is contained in:
commit
dd4fe67ac0
25
pkgs/applications/science/biology/dssp/default.nix
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25
pkgs/applications/science/biology/dssp/default.nix
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@ -0,0 +1,25 @@
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{ lib, stdenv, fetchFromGitHub, boost, cmake, libcifpp, zlib, }:
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stdenv.mkDerivation rec {
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pname = "dssp";
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version = "4.0.5";
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src = fetchFromGitHub {
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owner = "PDB-REDO";
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repo = pname;
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rev = "v${version}";
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sha256 = "1x35rdcm4fch66pjbmy73lv0gdb6g9y3v023a66512a6nzsqjsir";
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};
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nativeBuildInputs = [ cmake ];
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buildInputs = [ boost libcifpp zlib ];
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meta = with lib; {
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description = "Calculate the most likely secondary structure assignment given the 3D structure of a protein";
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homepage = "https://github.com/PDB-REDO/dssp";
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license = licenses.bsd2;
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maintainers = with maintainers; [ natsukium ];
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platforms = platforms.unix;
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};
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}
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25
pkgs/development/libraries/libcifpp/default.nix
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25
pkgs/development/libraries/libcifpp/default.nix
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@ -0,0 +1,25 @@
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{ lib, stdenv, fetchFromGitHub, boost, cmake, }:
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stdenv.mkDerivation rec {
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pname = "libcifpp";
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version = "4.2.0";
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src = fetchFromGitHub {
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owner = "PDB-REDO";
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repo = pname;
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rev = "v${version}";
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sha256 = "1hzi6fgbsmy8h8nfwkyfds9jz13nqw72h0x81jqw5516kkvar5iw";
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};
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nativeBuildInputs = [ cmake ];
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buildInputs = [ boost ];
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meta = with lib; {
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description = "Manipulate mmCIF and PDB files";
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homepage = "https://github.com/PDB-REDO/libcifpp";
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license = licenses.bsd2;
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maintainers = with maintainers; [ natsukium ];
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platforms = platforms.unix;
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};
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}
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@ -18729,6 +18729,8 @@ with pkgs;
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libchop = callPackage ../development/libraries/libchop { };
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libcifpp = callPackage ../development/libraries/libcifpp { };
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libcint = callPackage ../development/libraries/libcint { };
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libclc = callPackage ../development/libraries/libclc { };
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@ -33410,6 +33412,8 @@ with pkgs;
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diamond = callPackage ../applications/science/biology/diamond { };
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dssp = callPackage ../applications/science/biology/dssp { };
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ecopcr = callPackage ../applications/science/biology/ecopcr { };
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eggnog-mapper = callPackage ../applications/science/biology/eggnog-mapper { };
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