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Date:      Wed, 30 Mar 2011 13:05:29 GMT
From:      Gvozdikov Veniamin <g.veniamin@googlemail.com>
To:        freebsd-gnats-submit@FreeBSD.org
Subject:   misc/156059: Update port: science/massxpert up to 2.4.3
Message-ID:  <201103301305.p2UD5T3M027768@red.freebsd.org>
Resent-Message-ID: <201103301310.p2UDAAQO029277@freefall.freebsd.org>

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>Number:         156059
>Category:       misc
>Synopsis:       Update port: science/massxpert up to 2.4.3
>Confidential:   no
>Severity:       non-critical
>Priority:       low
>Responsible:    freebsd-bugs
>State:          open
>Quarter:        
>Keywords:       
>Date-Required:
>Class:          sw-bug
>Submitter-Id:   current-users
>Arrival-Date:   Wed Mar 30 13:10:10 UTC 2011
>Closed-Date:
>Last-Modified:
>Originator:     Gvozdikov Veniamin
>Release:        FreeBSD 8.2-RELEASE
>Organization:
>Environment:
FreeBSD LSD.zlonet.ru 8.2-RELEASE FreeBSD 8.2-RELEASE #0: Fri Feb 18 02:24:46 UTC 2011 root@almeida.cse.buffalo.edu:/usr/obj/usr/src/sys/GENERIC i386
>Description:
New version.
 Fixed a problem with considering that the lightest isotope was necessarily the most abundant isotope. In fact this is true for the main chemical elements in biological matter, but can be not true for other chemical elements. This fix will only matter to people using chemical elements of which the most abundant isotope is not the lightest one.
 Fixed a bug that crashed the program when the user would click (on the sequence editor) left of first monomer vignette.
 Added feature: when running the mz calculations dialog from the sequence editor window, the masses are automatically set in the dialog window. 
Added ion charge proton to the formula of the z fragmentation specification. 
Rewrote the Formula's elementalComposition() so that the order of the atoms is in the CHNO->alphabetic conventional order.
>How-To-Repeat:

>Fix:
diff -up massxpert.orig/Makefile massxpert/Makefile
--- massxpert.orig/Makefile	2011-03-30 21:00:30.000000000 +0800
+++ massxpert/Makefile	2011-03-30 16:16:38.000000000 +0800
@@ -6,14 +6,15 @@
 #
 
 PORTNAME=	massxpert
-PORTVERSION=	2.3.6
-PORTREVISION=	1
+PORTVERSION=	2.4.3
 CATEGORIES=	science
 MASTER_SITES=	http://download.tuxfamily.org/massxpert/source/
 
 MAINTAINER=	g.veniamin@googlemail.com
 COMMENT=	The massXpert software for (bio)chemists
 
+LICENSE=	GPLv3
+
 USE_QT_VER=	4
 USE_CMAKE=	yes
 QT_COMPONENTS=	gui xml rcc_build qmake_build uic_build moc_build \
diff -up massxpert.orig/distinfo massxpert/distinfo
--- massxpert.orig/distinfo	2011-03-30 21:00:30.000000000 +0800
+++ massxpert/distinfo	2011-03-30 16:15:50.000000000 +0800
@@ -1,3 +1,2 @@
-MD5 (massxpert-2.3.6.tar.gz) = e51cf36f01e78cf07a71e33a8e0f8ad7
-SHA256 (massxpert-2.3.6.tar.gz) = 9c28de0eb45c027551b52b865bae4a9cdcc874869cefadb3fe61a71e391f49e4
-SIZE (massxpert-2.3.6.tar.gz) = 14197098
+SHA256 (massxpert-2.4.3.tar.gz) = 2c8cb51b9d81c2ddf8a1f212d067d64dab066756a4b0c15e01ad6071c2741702
+SIZE (massxpert-2.4.3.tar.gz) = 14208974
Common subdirectories: massxpert.orig/files and massxpert/files
diff -up massxpert.orig/pkg-plist massxpert/pkg-plist
--- massxpert.orig/pkg-plist	2011-03-30 21:00:30.000000000 +0800
+++ massxpert/pkg-plist	2011-03-30 17:41:27.000000000 +0800
@@ -198,6 +198,8 @@ share/applications/massxpert.desktop
 %%DATADIR%%/pol-seqs/protein-3-letters.mxp
 %%DATADIR%%/pol-seqs/tev-protease-his-tag.mxp
 %%DATADIR%%/pol-seqs/yellow-fluorescent-protein.mxp
+%%DATADIR%%/pol-seqs/insulin-a-ox.mxp
+%%DATADIR%%/pol-seqs/insulin-b-ox.mxp
 %%DATADIR%%/dictionaries/codon-to-protein-1.dic
 %%DATADIR%%/dictionaries/codon-to-protein-3.dic
 %%DATADIR%%/dictionaries/pdb-protein-to-mxp.dic

>Release-Note:
>Audit-Trail:
>Unformatted:



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