From d41626bdf31badb7ac3c4a73a3725c6c1d23029b Mon Sep 17 00:00:00 2001 From: miwi Date: Fri, 2 Apr 2010 15:24:14 +0000 Subject: Perl module which provides functions for detecting the bonds in a molecule from its 3D coordinates by using simple cutoffs, and for guessing the formal bond orders. WWW: http://search.cpan.org/dist/Chemistry-Bond-Find/ PR: ports/145143 Submitted by: Steve Wills --- science/p5-Chemistry-Bond-Find/Makefile | 25 +++++++++++++++++++++++++ science/p5-Chemistry-Bond-Find/distinfo | 3 +++ science/p5-Chemistry-Bond-Find/pkg-descr | 5 +++++ science/p5-Chemistry-Bond-Find/pkg-plist | 7 +++++++ 4 files changed, 40 insertions(+) create mode 100644 science/p5-Chemistry-Bond-Find/Makefile create mode 100644 science/p5-Chemistry-Bond-Find/distinfo create mode 100644 science/p5-Chemistry-Bond-Find/pkg-descr create mode 100644 science/p5-Chemistry-Bond-Find/pkg-plist (limited to 'science/p5-Chemistry-Bond-Find') diff --git a/science/p5-Chemistry-Bond-Find/Makefile b/science/p5-Chemistry-Bond-Find/Makefile new file mode 100644 index 000000000000..0c01dcaa5460 --- /dev/null +++ b/science/p5-Chemistry-Bond-Find/Makefile @@ -0,0 +1,25 @@ +# New ports collection makefile for: p5-Chemistry-Bond-Find +# Date created: 2010-03-10 +# Whom: Steve Wills +# +# $FreeBSD$ +# + +PORTNAME= Chemistry-Bond-Find +PORTVERSION= 0.23 +CATEGORIES= science perl5 +MASTER_SITES= CPAN +MASTER_SITE_SUBDIR= ../../authors/id/I/IT/ITUB +PKGNAMEPREFIX= p5- + +MAINTAINER= steve@mouf.net +COMMENT= Detect bonds in a molecule and assign formal bond orders + +BUILD_DEPENDS= ${SITE_PERL}/Chemistry/Mol.pm:${PORTSDIR}/science/p5-Chemistry-Mol +RUN_DEPENDS= ${SITE_PERL}/Chemistry/Mol.pm:${PORTSDIR}/science/p5-Chemistry-Mol + +MAN3= Chemistry::Bond::Find.3 + +PERL_CONFIGURE= yes + +.include diff --git a/science/p5-Chemistry-Bond-Find/distinfo b/science/p5-Chemistry-Bond-Find/distinfo new file mode 100644 index 000000000000..082324cd7f55 --- /dev/null +++ b/science/p5-Chemistry-Bond-Find/distinfo @@ -0,0 +1,3 @@ +MD5 (Chemistry-Bond-Find-0.23.tar.gz) = c8ece363b723cdc1e085bf5cc5ae5cec +SHA256 (Chemistry-Bond-Find-0.23.tar.gz) = 07ee896bf91cbe94f46dca0bb0d222c0989432a6c8255691bafadcf4cbb3fae6 +SIZE (Chemistry-Bond-Find-0.23.tar.gz) = 9723 diff --git a/science/p5-Chemistry-Bond-Find/pkg-descr b/science/p5-Chemistry-Bond-Find/pkg-descr new file mode 100644 index 000000000000..a7ecd48b85c5 --- /dev/null +++ b/science/p5-Chemistry-Bond-Find/pkg-descr @@ -0,0 +1,5 @@ +Perl module which provides functions for detecting the bonds in a molecule from +its 3D coordinates by using simple cutoffs, and for guessing the formal bond +orders. + +WWW: http://search.cpan.org/dist/Chemistry-Bond-Find/ diff --git a/science/p5-Chemistry-Bond-Find/pkg-plist b/science/p5-Chemistry-Bond-Find/pkg-plist new file mode 100644 index 000000000000..74f8f5c0f545 --- /dev/null +++ b/science/p5-Chemistry-Bond-Find/pkg-plist @@ -0,0 +1,7 @@ +%%SITE_PERL%%/Chemistry/Bond/Find.pm +%%SITE_PERL%%/mach/auto/Chemistry/Bond/Find/.packlist +@dirrmtry %%SITE_PERL%%/Chemistry +@dirrmtry %%SITE_PERL%%/Chemistry/Bond +@dirrmtry %%SITE_PERL%%/mach/auto/Chemistry/Bond/Find +@dirrmtry %%SITE_PERL%%/mach/auto/Chemistry/Bond +@dirrmtry %%SITE_PERL%%/mach/auto/Chemistry -- cgit