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: Sun, 14 Mar 2021 19:15:15 +0000 (UTC) [thread overview]
Message-ID: <1615749303.e4fdd0ad2100160149ebe6fb77dfb643a65de55f.junghans@gentoo> (raw)
commit: e4fdd0ad2100160149ebe6fb77dfb643a65de55f
Author: Christoph Junghans <junghans <AT> gentoo <DOT> org>
AuthorDate: Sun Mar 14 19:14:40 2021 +0000
Commit: Christoph Junghans <junghans <AT> gentoo <DOT> org>
CommitDate: Sun Mar 14 19:15:03 2021 +0000
URL: https://gitweb.gentoo.org/repo/gentoo.git/commit/?id=e4fdd0ad
sci-chemistry/votca-xtp: version bump
Package-Manager: Portage-3.0.13, 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-2021.ebuild | 43 +++++++++++++++++++++++++++
2 files changed, 44 insertions(+)
diff --git a/sci-chemistry/votca-xtp/Manifest b/sci-chemistry/votca-xtp/Manifest
index c0ed4cb5aac..629203b5c08 100644
--- a/sci-chemistry/votca-xtp/Manifest
+++ b/sci-chemistry/votca-xtp/Manifest
@@ -1,2 +1,3 @@
DIST votca-xtp-1.6.4.tar.gz 1405299 BLAKE2B 9d4e9d3f87e0c6be886df77bf52f9d8c0b4010fb1d77621a51b739986f3f5d70c85637c0d7b4d6a8a06d7dfc7e70ff5491bdc833a1b9da6fe1e8a9742a82d220 SHA512 f35e9605f4ac92547c801b254de792b5c3bf40200e8636869467997412357251df08f88ad851bc76cb0ba15428f06f28dbd4f64043a7612273468c8d653e52af
DIST votca-xtp-1.6.tar.gz 1404955 BLAKE2B 1599281ea1cd6b5a93b1d91f69a793af7bb9cd2fbf70157e5d40a5bfc72f973f3d97338f92157c2c482ad041f8afda298282b1f83dda66d0bb189bdc07bb5a23 SHA512 cb99c31fe7f1af53b8ccf50cc9cc304ed5c5b5d1a165e1a72a456c0bbf5ac8bb9263c9eff829acc74be348192afbf80fd4d80a2c20d1dd5d7f909b1b50368670
+DIST votca-xtp-2021.tar.gz 2192166 BLAKE2B bcacdfe92b8c9fbbe2fe949d7096c09928ef7ece3cc4e40adbf58f2894036588762f9905bce1a1595bea99d1dfb8bcd99f395bed2ce7b94eeaf51b1c33719558 SHA512 1444fd0a64a684fd2b1327a9c3af067ea812190fa95cab5f3bfcc7aae932cc7469d07fc219871ca594496fbfe74e277d3b6ccfbd7d5c24c162623515ee2fef0b
diff --git a/sci-chemistry/votca-xtp/votca-xtp-2021.ebuild b/sci-chemistry/votca-xtp/votca-xtp-2021.ebuild
new file mode 100644
index 00000000000..a1148a82dcb
--- /dev/null
+++ b/sci-chemistry/votca-xtp/votca-xtp-2021.ebuild
@@ -0,0 +1,43 @@
+# Copyright 1999-2021 Gentoo Authors
+# Distributed under the terms of the GNU General Public License v2
+
+EAPI=7
+
+inherit bash-completion-r1 cmake
+
+if [[ ${PV} == *9999 ]]; then
+ inherit git-r3
+ EGIT_REPO_URI="https://github.com/${PN/-//}.git"
+else
+ SRC_URI="https://github.com/${PN/-//}/archive/v${PV}.tar.gz -> ${P}.tar.gz"
+ KEYWORDS="~amd64 ~x86 ~amd64-linux"
+ S="${WORKDIR}/${P#votca-}"
+fi
+
+DESCRIPTION="Votca excitation and charge properties module"
+HOMEPAGE="https://www.votca.org/"
+
+LICENSE="Apache-2.0"
+SLOT="0"
+IUSE=""
+
+RDEPEND="
+ >=dev-cpp/eigen-3.3
+ ~sci-chemistry/votca-csg-${PV}
+ sci-libs/hdf5[cxx]
+ sci-libs/libxc
+ sci-libs/libint:2
+ ~sci-libs/votca-tools-${PV}
+"
+DEPEND="${RDEPEND}"
+BDEPEND="virtual/pkgconfig"
+
+DOCS=( README.rst NOTICE.rst CHANGELOG.rst )
+
+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:[~2021-03-14 19:15 UTC|newest]
Thread overview: 35+ messages / expand[flat|nested] mbox.gz Atom feed top
2021-03-14 19:15 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
2021-02-28 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
2020-12-10 19:26 Christoph Junghans
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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