diff --git a/science/massxpert/Makefile b/science/massxpert/Makefile index 892bbb753a16..289a32633b4d 100644 --- a/science/massxpert/Makefile +++ b/science/massxpert/Makefile @@ -1,30 +1,29 @@ # Created by: Veniamin Gvozdikov PORTNAME= massxpert DISTVERSION= 6.0.3 CATEGORIES= science MAINTAINER= salvadore@FreeBSD.org COMMENT= Software suite for (bio)chemists LICENSE= GPLv3 LICENSE_FILE= ${WRKSRC}/LICENSE BUILD_DEPENDS= ${LOCALBASE}/libdata/pkgconfig/pthread-stubs.pc:devel/libpthread-stubs LIB_DEPENDS= libexpat.so:textproc/expat2 \ libfontconfig.so:x11-fonts/fontconfig \ libfreetype.so:print/freetype2 \ - libpcre.so:devel/pcre \ libpng.so:graphics/png -USES= cmake gnome qt:5 tar:bzip2 xorg +USES= cmake compiler:c++17-lang gnome qt:5 xorg USE_GITLAB= yes GL_SITE= https://salsa.debian.org/ GL_ACCOUNT= debichem-team GL_COMMIT= a21ad33eee0314df202146392023dfb3868b7d84 USE_GNOME= glib20 USE_QT= core gui printsupport svg widgets xml buildtools_build \ qmake_build USE_XORG= ice sm x11 xau xcb xdmcp xext xrender .include diff --git a/science/massxpert/pkg-descr b/science/massxpert/pkg-descr index 6ad116f435a0..835d908097ec 100644 --- a/science/massxpert/pkg-descr +++ b/science/massxpert/pkg-descr @@ -1,20 +1,20 @@ The massXpert project aims at providing (bio)chemists with a software package allowing the following: * User-specific atom definitions and polymer chemistry definitions; * Powerful sequence editing with user-defined glyphs for each monomer and monomer chemical modification. Multi-region selections; * Polymer sequence chemical/enzymatic cleavage; * Intramolecular cross-linking, like disulfide bonds with total resolution of the peptides generated upon enzymatic cleavage; * Gas-phase fragmentation of oligomers; * Mass-to-charge ratio calculations with inline change of ionization agent; * Calculation of net electrical charge and of isoelectric point (even by taking into account monomer modifications if polymer is a protein); * Simulation of isotopic patterns for any chemical formula and z charge; * A number of plugins allow 1) translation of the sequence from one format to another (using a dictionary, like between the 1-letter code and the 3-letter code of proteins) 2) conversion of number format according to any localized number format 3) sort mass lists. -WWW: https://salsa.debian.org/debichem-team/massxpert +WWW: http://www.msxpertsuite.org