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authorV3n3RiX <venerix@koprulu.sector>2022-12-04 21:03:51 +0000
committerV3n3RiX <venerix@koprulu.sector>2022-12-04 21:03:51 +0000
commitc4d92ab721dfc646b4a58429d965e9446294ce26 (patch)
tree8c0c331362f99c256c191229ac424b1cc8698005 /sci-chemistry/dssp
parent5565fb7867ee9faddf046e42a0a3a1a207803938 (diff)
gentoo auto-resync : 04:12:2022 - 21:03:51
Diffstat (limited to 'sci-chemistry/dssp')
-rw-r--r--sci-chemistry/dssp/Manifest4
-rw-r--r--sci-chemistry/dssp/dssp-4.2.0.ebuild31
-rw-r--r--sci-chemistry/dssp/metadata.xml3
3 files changed, 37 insertions, 1 deletions
diff --git a/sci-chemistry/dssp/Manifest b/sci-chemistry/dssp/Manifest
index 3e8fd1cd8126..56a5a1d876ad 100644
--- a/sci-chemistry/dssp/Manifest
+++ b/sci-chemistry/dssp/Manifest
@@ -5,8 +5,10 @@ DIST dssp-2.2.1.tgz 47141 BLAKE2B 34d8b2db8797a8c23763766c0214337f03584c4be52c1b
DIST dssp-3.0.11.tar.gz 168085 BLAKE2B e1c42fd22cfb2287f10b5deae48b56a4583d4a67737a3485dcbd160d1597a15c2d5105c3794c875d8001abede1c014efb4f7f5b7c250f867bdf9ed95a0860217 SHA512 a0cfe44e517ff1f909ef2928b62ae2c639c6bddfd8a0fb538883f647fd2771e00da68e0fd2521aa02ba3c6d1b0c9b784b7fe142392af3a3abf6ea89f1546bd9d
DIST dssp-4.0.3.tar.gz 122872 BLAKE2B f88c330370645b4bd4e89656ad676e443a33c38d7882145bc60e329f823eb761777713df6c7ae44550d10bcd22256ac16db358587cadd39efd6268dd869655d4 SHA512 31ca481b097c9c59f407e35eb8175638b5e4102991007090b5b4ea30db0b076f97cff45d0aa9ae01a826f7673258464b572d68714f00e210db26020cea4be094
DIST dssp-4.0.4.tar.gz 122183 BLAKE2B b12702c482ad58f09d96e9c85759ebe9455961978277e25d1ee554d07a643b342acf2dbcd3c18d539f058b970c24888a43827b6bac47899ca61bf96dd0c2723b SHA512 e0646bb20f10617174b0970c549fd44990750f46f7a550e4c3bc89487a8d3b7a175d53b2abb0684f9d96203a23d64ae67c6c10688fd4f5f59ff19995f9149ef8
+DIST dssp-4.2.0.tar.gz 157104 BLAKE2B 4caffb5f7cfe2a130e3ac6c5efa41689bbbb8ee054333cd4320cf77ac36dccaa128fe816ca57b6bd287271924122de4252076628098db415c854df6f09c17ac2 SHA512 b86c736ea9fdf62be923f8a69bae56f7298cd01e6623c1f3eee6951e20483d24438b1318924e980b6a98b19c77cb84d4ba66260a575b63e7c536ecba0478c4a5
EBUILD dssp-2.2.1-r3.ebuild 869 BLAKE2B a0941bcc1b057c0a8fc8aede77313cd79d9a81ac2ac23fb3cd3c0b79dbd13d028fa24ad83227fb8b582e63cc4a62ceaddebf2db710757d5fa4cfee83ca5438cf SHA512 84e21152a4de933ebe82a5cdf7bf66992f871ab2e4d8c3de974fae066e191c595a4de43680cbdd81265c6b638353d7d858d117f5c532894a1da7fac6e6018a43
EBUILD dssp-3.0.11.ebuild 874 BLAKE2B fb962065caca88ba6eb8eb8aec44c870b5d6a66fa068bf1f48e328202a1ad2deef717d6163bff8839b25545edfe5241fb4a69ea5bce73ff349f16e9959fd4ade SHA512 823ef9d37cf8793d9151770b831afa5f221906b3dfa57aa07aba8ddb19d6c95e00f88c9043c04efcfff1cbbad14931205d625523311da43ba5dc8eeecd4dc144
EBUILD dssp-4.0.3.ebuild 758 BLAKE2B e3a7897f0799d7d955bcc141589eda35a4652b5dd0c9200c965c3ee271498354ee57eb24c70a92e6ca5f18c6c548c9bb4b81420d05118dc26b3c2b528bf0923e SHA512 9aa91e10112c5a04d3fd7185d22070b9b4bd055353a4e832499c46066129b2b4f8a0cf464c2d458355658d8070c2a4b15b06027d69ee40d7340b42150fbd4c76
EBUILD dssp-4.0.4.ebuild 762 BLAKE2B 684d44f77f703492327d8d6e15450f9886a6b37fbc1e72f0ff3977b7c0503c16035fa00c8bd2d2999714de87478404e31ba949852628b8b42a5763a9a4686b97 SHA512 8a1bf8b0661d5d5dbcc2e09dd9ec14b4ad14f559e8734bdee3a7fac4e1e3614da191141b4131a98b7f62678901d306eb410450adb698910f8b2a8f443da66294
-MISC metadata.xml 217 BLAKE2B f8189b02494f180dac078dcd5c275d3c795f20f360f8b172c66065a2d937e396b24b8631bba4cd8567d60285ce89fc77b9539f2233bf33899c820613c48c33ba SHA512 f0c9e5b3d281fecd21b1e23a6f44c94c1c0b3220de46a177d35932111b7f1ab4399061c42833ac1ee9bd0324b139fc8db66e0d2890224d607bd3be38ae469be9
+EBUILD dssp-4.2.0.ebuild 783 BLAKE2B 7ee0a8373872472e9b851dcaeb24bbd4250be574d8d09082df2800eaa54cdf674328f335223234f4ab0bbc05ba716503ec6e58ee9efa7c6cdbb1185171ef2b6f SHA512 b88039f6695f663c2145a2928348daecfcec0509f5da593602c0d2533a81b27ca2bd0852b353e66cd2f9887706fb8f7552864eab61fce95284587ebfdb8e34f9
+MISC metadata.xml 295 BLAKE2B 4355bbe00822cc702acdf70031ab9cd1f2a8f6e076d71016c1783f2a6c052c2da0a1a4a1860062562bb837161787f2481fa6f49c4319c546482a263ebe149bb0 SHA512 ace35ca21c614a7c0cbdea2496be3190a907295053566707c1875836a306cc9e9c96816cca6ce2b514935f6fcd494d2e813f4d94ba88552cd7b86831f30501f4
diff --git a/sci-chemistry/dssp/dssp-4.2.0.ebuild b/sci-chemistry/dssp/dssp-4.2.0.ebuild
new file mode 100644
index 000000000000..2aa19298ec94
--- /dev/null
+++ b/sci-chemistry/dssp/dssp-4.2.0.ebuild
@@ -0,0 +1,31 @@
+# Copyright 1999-2022 Gentoo Authors
+# Distributed under the terms of the GNU General Public License v2
+
+EAPI=8
+inherit cmake
+
+DESCRIPTION="The protein secondary structure standard"
+HOMEPAGE="https://swift.cmbi.umcn.nl/gv/dssp/ https://github.com/PDB-REDO/dssp"
+SRC_URI="https://github.com/PDB-REDO/${PN}/archive/refs/tags/v${PV}.tar.gz -> ${P}.tar.gz"
+
+LICENSE="BSD-2"
+SLOT="0"
+KEYWORDS="~amd64"
+IUSE=""
+
+BDEPEND="
+ dev-libs/boost:=[zlib]
+ >=dev-libs/libmcfp-1.2.2
+ >=sci-libs/libcifpp-5.0.4
+"
+DEPEND=""
+RDEPEND="${BDEPEND}"
+
+pkg_postinst() {
+ if has_version "<=sci-chemistry/gromacs-2022"; then
+ ewarn "DSSP > 3.0.x is not compatible with gmx do_dssp:"
+ ewarn "https://gitlab.com/gromacs/gromacs/-/issues/4129"
+ ewarn
+ ewarn "Feel free to mask newer versions if needed."
+ fi
+}
diff --git a/sci-chemistry/dssp/metadata.xml b/sci-chemistry/dssp/metadata.xml
index 572c7daf2ccf..e3c02bf1bb6f 100644
--- a/sci-chemistry/dssp/metadata.xml
+++ b/sci-chemistry/dssp/metadata.xml
@@ -4,4 +4,7 @@
<maintainer type="person">
<email>pacho@gentoo.org</email>
</maintainer>
+ <upstream>
+ <remote-id type="github">PDB-REDO/dssp</remote-id>
+ </upstream>
</pkgmetadata>