From: "Christoph Junghans" <junghans@gentoo.org>
To: gentoo-commits@lists.gentoo.org
Subject: [gentoo-commits] repo/gentoo:master commit in: sci-chemistry/votca-xtp/
Date: Thu, 10 Dec 2020 19:26:09 +0000 (UTC) [thread overview]
Message-ID: <1607628362.bb1bb9cb2baf133ad802e5a85ff09fa3536dea34.junghans@gentoo> (raw)
commit: bb1bb9cb2baf133ad802e5a85ff09fa3536dea34
Author: Christoph Junghans <junghans <AT> gentoo <DOT> org>
AuthorDate: Thu Dec 10 19:25:47 2020 +0000
Commit: Christoph Junghans <junghans <AT> gentoo <DOT> org>
CommitDate: Thu Dec 10 19:26:02 2020 +0000
URL: https://gitweb.gentoo.org/repo/gentoo.git/commit/?id=bb1bb9cb
sci-chemistry/votca-xtp: version bump to v1.6.3
Package-Manager: Portage-3.0.9, Repoman-3.0.2
Signed-off-by: Christoph Junghans <junghans <AT> gentoo.org>
sci-chemistry/votca-xtp/Manifest | 1 +
sci-chemistry/votca-xtp/votca-xtp-1.6.3.ebuild | 45 ++++++++++++++++++++++++++
2 files changed, 46 insertions(+)
diff --git a/sci-chemistry/votca-xtp/Manifest b/sci-chemistry/votca-xtp/Manifest
index 255335e1387..af3c7ca11cc 100644
--- a/sci-chemistry/votca-xtp/Manifest
+++ b/sci-chemistry/votca-xtp/Manifest
@@ -4,6 +4,7 @@ DIST votca-xtp-1.5.1.tar.gz 14634849 BLAKE2B 84ee9fc531a530ba276a6fd3eccc78dd25c
DIST votca-xtp-1.5.tar.gz 14637712 BLAKE2B af04de706f0d100968928459a03b6a94a94a211b3f5bd056d123756d40760fb0ada70add429ed5b86e211dbdd3b91aa4cf12e51a260638766d04158e7b5a1201 SHA512 693f34004749edfbabcd0a19dc23b3de3c09858c7c0dfe1e420b92632397971e3687489c1074a489d4d2fd337ddc5749c419869db104c65736e7c01bf12cd140
DIST votca-xtp-1.6.1.tar.gz 1405246 BLAKE2B b32db1e50ebfd79683ea2bf990293d9dfcf7703f3d95467a3fac5f98ec98e9bf1d29bab079e8f328fab8998144af186e7f47e99d9312763f7d73a1ae364ce58a SHA512 8b1bb235e70c239d0c57ceac65cd384841ea136d61f28bc72cbe2cfb47f9d776d42e06180acd1d8da93d0a0586e0bc3884ed82830d0f31c498ce225ca79a45aa
DIST votca-xtp-1.6.2.tar.gz 1405868 BLAKE2B 4e5700cec41ede632b97904259040aef2b79f9698547bf508584e49ff5cb16ab627c31732136de67bed3f70af9bf890a25bf511e8d9278821107760fc29441b7 SHA512 64610239ef5b902daa4ff475b4fea194912ef2a50e24214fcecf7d63336208a642c5ae5f02b0f21d04a78acaef224ba9a29b06b9380dbd6a43553e704efc54fe
+DIST votca-xtp-1.6.3.tar.gz 1405361 BLAKE2B 35b73f754f6485c96624e75db7583559601e286d1a782259266f7a4e210ab21615d8ba6d308975483428091bf58a55b8fc96327543c17f8b5786744560cdf239 SHA512 2de786a10a3776b6a6e187cd1c42b173cb912b1169b6283ccd245fac9b2f03a94235b2ff8a372dee83e33f6669211b1f79573b099ad9775971ece79a88ac990c
DIST votca-xtp-1.6.tar.gz 1404955 BLAKE2B 1599281ea1cd6b5a93b1d91f69a793af7bb9cd2fbf70157e5d40a5bfc72f973f3d97338f92157c2c482ad041f8afda298282b1f83dda66d0bb189bdc07bb5a23 SHA512 cb99c31fe7f1af53b8ccf50cc9cc304ed5c5b5d1a165e1a72a456c0bbf5ac8bb9263c9eff829acc74be348192afbf80fd4d80a2c20d1dd5d7f909b1b50368670
DIST votca-xtp-1.6_rc1.tar.gz 13586771 BLAKE2B d5b72a7389b77df0570eac0021870bba3fa66a89b3a2df1e08632b1c1827884d101ef8d972762dae35e44e53e7a9fe9278d3204eec09c35d091ab3427b055be4 SHA512 0b54eddcf944967b1d41f75f4887eba9edc3be18b94d319e93e795a24f58a2877d7f60afd806290eacb41d329d1b1206ebaab83874d6be2d5b026f06dbc19dfd
DIST votca-xtp-manual-1.4.1.pdf 1066873 BLAKE2B 8cbd4b55b013794a19a8b5867b929b8e2d9084e6780d777b2a2bbaea23006f4f4ec5b26bd4a07c59e1c6726f23471eb1756b668636e0c4e656a0807e64197586 SHA512 fdf1147f24785524f5e96020fcd29c32bbeef520eebf6afba32b59d7e777d586c452919478d2734c3f021e558b1147b945cdbc0833402be2b16e5af3a8e37f5f
diff --git a/sci-chemistry/votca-xtp/votca-xtp-1.6.3.ebuild b/sci-chemistry/votca-xtp/votca-xtp-1.6.3.ebuild
new file mode 100644
index 00000000000..116b226b03f
--- /dev/null
+++ b/sci-chemistry/votca-xtp/votca-xtp-1.6.3.ebuild
@@ -0,0 +1,45 @@
+# Copyright 1999-2020 Gentoo Authors
+# Distributed under the terms of the GNU General Public License v2
+
+EAPI=7
+
+CMAKE_MAKEFILE_GENERATOR="ninja"
+
+inherit bash-completion-r1 cmake multilib
+
+IUSE=""
+if [ "${PV}" != "9999" ]; then
+ SRC_URI="https://github.com/${PN/-//}/archive/v${PV}.tar.gz -> ${P}.tar.gz"
+ KEYWORDS="~amd64 ~x86 ~amd64-linux ~x86-macos"
+ S="${WORKDIR}/${P#votca-}"
+else
+ inherit git-r3
+ EGIT_REPO_URI="https://github.com/${PN/-//}.git"
+ KEYWORDS=""
+fi
+
+DESCRIPTION="Votca excitation and charge properties module"
+HOMEPAGE="http://www.votca.org"
+
+LICENSE="Apache-2.0"
+SLOT="0"
+
+RDEPEND="
+ ~sci-libs/votca-tools-${PV}
+ >=dev-cpp/eigen-3.3
+ sci-libs/hdf5[cxx]
+ ~sci-chemistry/votca-csg-${PV}
+ sci-libs/libxc"
+
+DEPEND="${RDEPEND}
+ virtual/pkgconfig"
+
+DOCS=( README.md NOTICE CHANGELOG.md )
+
+pkg_postinst() {
+ einfo
+ einfo "Please read and cite:"
+ einfo "VOTCA-XTP, J. Chem. Theo. Comp. 14, 6353 (2018)"
+ einfo "https://doi.org/10.1021/acs.jctc.8b00617"
+ einfo
+}
next reply other threads:[~2020-12-10 19:26 UTC|newest]
Thread overview: 35+ messages / expand[flat|nested] mbox.gz Atom feed top
2020-12-10 19:26 Christoph Junghans [this message]
-- strict thread matches above, loose matches on Subject: below --
2022-02-20 14:58 [gentoo-commits] repo/gentoo:master commit in: sci-chemistry/votca-xtp/ Christoph Junghans
2022-02-20 14:58 Christoph Junghans
2021-09-19 15:20 Christoph Junghans
2021-07-18 23:24 Christoph Junghans
2021-04-05 16:53 Andreas Sturmlechner
2021-03-28 10:02 Agostino Sarubbo
2021-03-27 16:07 Sam James
2021-03-19 19:46 Christoph Junghans
2021-03-14 19:15 Christoph Junghans
2021-02-28 18:08 Andreas Sturmlechner
2021-01-18 10:14 David Seifert
2021-01-13 1:20 Christoph Junghans
2021-01-06 15:10 Fabian Groffen
2020-08-22 23:36 Christoph Junghans
2020-06-21 15:41 Christoph Junghans
2020-04-18 5:01 Christoph Junghans
2020-04-02 22:05 Christoph Junghans
2020-01-12 21:51 Christoph Junghans
2019-11-22 2:26 Christoph Junghans
2019-05-20 11:03 Mikle Kolyada
2019-01-31 20:16 Christoph Junghans
2018-10-02 12:58 Christoph Junghans
2018-09-28 12:37 Christoph Junghans
2018-09-27 17:31 Christoph Junghans
2018-09-27 17:31 Christoph Junghans
2017-09-04 18:06 Christoph Junghans
2017-09-03 14:55 Christoph Junghans
2017-09-03 13:41 Christoph Junghans
2017-07-30 10:04 Michał Górny
2016-12-20 14:30 Tobias Klausmann
2016-12-09 17:25 Christoph Junghans
2016-11-14 2:01 Christoph Junghans
2016-10-29 21:41 Christoph Junghans
2016-09-27 18:13 Christoph Junghans
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