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authorPacho Ramos <pacho@gentoo.org>2023-02-26 16:50:20 +0100
committerPacho Ramos <pacho@gentoo.org>2023-02-26 16:51:33 +0100
commit266ba3510001630233931bb9bd9dae60a233658a (patch)
tree15ea58949bd24e2d757b3ae3d56276a450d84b6f /sci-chemistry/dssp
parentsci-libs/libcifpp: add 5.0.8 (diff)
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sci-chemistry/dssp: add 4.2.2.1
Signed-off-by: Pacho Ramos <pacho@gentoo.org>
Diffstat (limited to 'sci-chemistry/dssp')
-rw-r--r--sci-chemistry/dssp/Manifest1
-rw-r--r--sci-chemistry/dssp/dssp-4.2.2.1.ebuild31
2 files changed, 32 insertions, 0 deletions
diff --git a/sci-chemistry/dssp/Manifest b/sci-chemistry/dssp/Manifest
index adb164c9b6da..e98a71770449 100644
--- a/sci-chemistry/dssp/Manifest
+++ b/sci-chemistry/dssp/Manifest
@@ -2,3 +2,4 @@ DIST dssp-2.2.1.tgz 47141 BLAKE2B 34d8b2db8797a8c23763766c0214337f03584c4be52c1b
DIST dssp-3.0.11.tar.gz 168085 BLAKE2B e1c42fd22cfb2287f10b5deae48b56a4583d4a67737a3485dcbd160d1597a15c2d5105c3794c875d8001abede1c014efb4f7f5b7c250f867bdf9ed95a0860217 SHA512 a0cfe44e517ff1f909ef2928b62ae2c639c6bddfd8a0fb538883f647fd2771e00da68e0fd2521aa02ba3c6d1b0c9b784b7fe142392af3a3abf6ea89f1546bd9d
DIST dssp-4.0.4.tar.gz 122183 BLAKE2B b12702c482ad58f09d96e9c85759ebe9455961978277e25d1ee554d07a643b342acf2dbcd3c18d539f058b970c24888a43827b6bac47899ca61bf96dd0c2723b SHA512 e0646bb20f10617174b0970c549fd44990750f46f7a550e4c3bc89487a8d3b7a175d53b2abb0684f9d96203a23d64ae67c6c10688fd4f5f59ff19995f9149ef8
DIST dssp-4.2.0.tar.gz 157104 BLAKE2B 4caffb5f7cfe2a130e3ac6c5efa41689bbbb8ee054333cd4320cf77ac36dccaa128fe816ca57b6bd287271924122de4252076628098db415c854df6f09c17ac2 SHA512 b86c736ea9fdf62be923f8a69bae56f7298cd01e6623c1f3eee6951e20483d24438b1318924e980b6a98b19c77cb84d4ba66260a575b63e7c536ecba0478c4a5
+DIST dssp-4.2.2.1.tar.gz 144413 BLAKE2B 97c587bc0b4ef3d212ae81d568f817aab54f1dd2a77d170746e9b0d3f1bd63873d21fb0a7fc38c0300fc091f21241820d5d009d42a9e3e33dcc608c046185d9f SHA512 6daa41aea766940bf40afaee068daef341a7f79cae79d967b8da00e7002bdb602deaed40e452a5f0cea9aa2041a5c8678dfcae2e0f595cc5a0856392162dcdff
diff --git a/sci-chemistry/dssp/dssp-4.2.2.1.ebuild b/sci-chemistry/dssp/dssp-4.2.2.1.ebuild
new file mode 100644
index 000000000000..32167a786c22
--- /dev/null
+++ b/sci-chemistry/dssp/dssp-4.2.2.1.ebuild
@@ -0,0 +1,31 @@
+# Copyright 1999-2023 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 -> ${P}.tar.gz"
+
+LICENSE="BSD-2"
+SLOT="0"
+KEYWORDS="~amd64 ~x86"
+IUSE=""
+
+BDEPEND="
+ dev-libs/boost:=[zlib]
+ >=dev-libs/libmcfp-1.2.2
+ >=sci-libs/libcifpp-5.0.8
+"
+DEPEND=""
+RDEPEND="${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
+}