debian/0000755000000000000000000000000012255405305007167 5ustar debian/copyright0000644000000000000000000000304211760646543011134 0ustar Format: http://dep.debian.net/deps/dep5 Upstream-Name: ShelXle Upstream-Contact: http://ewald.ac.chemie.uni-goettingen.de/shelx/ Source: http://sourceforge.net/projects/shelxle/files/ Disclaimer: Please cite this article if you find this program useful: C. B. Hübschle, G. M. Sheldrick and B. Dittrich, ShelXle: a Qt graphical user interface for SHELXL, J. Appl. Cryst., 44, (2011) 1281-1284. . http://dx.doi.org/10.1107/S0021889811043202 http://journals.iucr.org/j/issues/2011/06/00/kk5092/kk5092.pdf Files: * Copyright: 2010-2011 Christian B. Huebschle License: LGPL-2.0+ Files: debian/* Copyright: 2011 Christian B. Huebschle 2011,2012 Debichem Team License: LGPL-2.0+ License: LGPL-2.0+ This package is free software; you can redistribute it and/or modify it under the terms of the GNU Lesser General Public License as published by the Free Software Foundation; either version 2 of the License, or (at your option) any later version. . This package is distributed in the hope that it will be useful, but WITHOUT ANY WARRANTY; without even the implied warranty of MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU Lesser General Public License for more details. . You should have received a copy of the GNU General Public License along with this program. If not, see . . On Debian systems, the complete text of the GNU Lesser General Public License can be found in "/usr/share/common-licenses/LGPL-2". debian/shelxle.install0000644000000000000000000000004611716773401012231 0ustar debian/shelxle.xpm usr/share/pixmaps/ debian/shelxle.10000644000000000000000000000255411716775437010744 0ustar .TH "ShelXle" "1" "2012-07-01" "" "User commands" .SH NAME shelxle \- graphical user interface for SHELXL .SH SYNOPSIS .B shelxle .RB [ options ] .RI [ file ] .SH DESCRIPTION .B ShelXle combines an editor with syntax highlighting for the SHELXL-associated \fI.ins\fR (input) and \fI.res\fR (output) files with an interactive graphical display for visualization of a three-dimensional structure including the electron density (Fo) and difference density (Fo-Fc) maps. .SH OPTIONS There are currently only a few options supported, which are mainly targeted to debugging. It further supports the traditional QT (X11) options, see \fBqtoptions\fR(7). The program further optionally accepts a path to a \fI.res\fR or \fI.ins\fR file. .SH CITATION Please cite this article if you find this program useful: .PP C. B. Hübschle, G. M. Sheldrick and B. Dittrich, ShelXle: a Qt graphical user interface for SHELXL, J. Appl. Cryst., 44, (2011) 1281-1284. .PP See the following URLs: .sp .nf \fI\%http://dx.doi.org/10.1107/S0021889811043202\%\fR \fI\%http://journals.iucr.org/j/issues/2011/06/00/kk5092/kk5092.pdf\%\fR .fi .SH "SEE ALSO" .BR qtoptions (7) .SH AUTHORS The program author is \fBChristian B. Huebschle\fR <\&chuebsch@moliso.de\&>. .PP This manual page page was written by \fBDaniel Leidert\fR <\&daniel.leidert@wgdd.de\&> for the Debian distribution (but may be used by others). debian/source/0000755000000000000000000000000012255405305010467 5ustar debian/source/format0000644000000000000000000000001411716773401011703 0ustar 3.0 (quilt) debian/shelxle.links0000644000000000000000000000005511773371425011706 0ustar usr/share/shelxle usr/share/doc/shelxle/help debian/shelxle.manpages0000644000000000000000000000002111716773401012347 0ustar debian/shelxle.1 debian/rules0000755000000000000000000000007711716773401010261 0ustar #!/usr/bin/make -f #export DH_VERBOSE=1 %: dh $@ --parallel debian/watch0000644000000000000000000000012611716773401010225 0ustar # See uscan(1) for format version=3 http://sf.net/shelxle/shelxle-([\d.]+)\.tar\.bz2 debian/patches/0000755000000000000000000000000012255405305010616 5ustar debian/patches/disable_update_search.patch0000644000000000000000000000102411716775437016147 0ustar Disable the automatic update search. --- a/window.cpp +++ b/window.cpp @@ -1170,7 +1170,7 @@ chgl->backGroundColor=mole.einstellung->value("BackGroundColor",QColor("lightskyblue")).value(); chgl->labelColor=mole.einstellung->value("LabelColor").value(); mole.einstellung->endGroup(); - int ignore=QMessageBox::Yes; + int ignore=QMessageBox::No; mole.einstellung->beginGroup("Updates"); if (mole.einstellung->contains("IgnoreUpdates")) ignore=mole.einstellung->value("IgnoreUpdates").toInt(); debian/patches/series0000644000000000000000000000003411716775437012051 0ustar disable_update_search.patch debian/upstream0000644000000000000000000000131411760140051010743 0ustar Name: ShelXle Homepage: http://ewald.ac.chemie.uni-goettingen.de/shelx/ Contact: Christian B. Hübschle Reference: - Author: Christian B. Hübschle and George M. Sheldrick and Birger Dittrich Title: "ShelXle: a Qt graphical user interface for SHELXL" Journal: J. Appl. Cryst. Year: 2011 Volume: 44 Number: 6 Pages: 1281-1284 URL: http://journals.iucr.org/j/issues/2011/06/00/kk5092/ eprint: http://journals.iucr.org/j/issues/2011/06/00/kk5092/kk5092.pdf DOI: 10.1107/S0021889811043202 Registration: http://ewald.ac.chemie.uni-goettingen.de/shelx/anmelden.php Repository: svn://svn.code.sf.net/p/shelxle/code/ Repository-Browse: http://sourceforge.net/p/shelxle/code/ debian/shelxle.xpm0000644000000000000000000001734511716773401011401 0ustar /* XPM */ static char *shelxle[] = { /* columns rows colors chars-per-pixel */ "32 32 256 2 ", " c #000000000016", ". c #0B1F079806A1", "X c #10200E32075A", "o c #1AC118B00D85", "O c #1D040000120D", "+ c #248C03D4154F", "@ c #189B225F1BEC", "# c #3BB932790786", "$ c #24BD2328187A", "% c #28B426CD1A3A", "& c #2BF229FC1BB1", "* c #23FF223B171E", "= c #1CCD2A8724DA", "- c #18C12E7F3A76", "; c #38AD36FB277D", ": c #4DC8077D2D87", "> c #5B620C9331F7", ", c #61F909763905", "< c #696C0AD73DCF", "1 c #61C819693340", "2 c #4A01454424BD", "3 c #54E44F7D264A", "4 c #65BF5C9C2A06", "5 c #61D05DE63EF2", "6 c #693D62D739A3", "7 c #6F160C8C418C", "8 c #75CC0D24455B", "9 c #4B423CA4451E", "0 c #35025A475BC5", "q c #39FD61A663DC", "w c #52354A31582B", "e c #751770284761", "r c #75B974D35D31", "t c #44F7716B6C22", "y c #413E6C787509", "u c #FFFF30600000", "i c #868E66432F23", "p c #9CC374702865", "a c #FFFF73FF0000", "s c #80800E264BE1", "d c #89120E855088", "f c #B1C2128E67DD", "g c #B2F82A58726B", "h c #B3FC30547749", "j c #C8D7169E76DF", "k c #D69D197F7F21", "l c #D0AC22776F99", "z c #18D2FFFF02BA", "x c #0000FFFF3429", "c c #60A5FFFF0000", "v c #0000FFFF7FE2", "b c #BDEFA8A43A18", "n c #FFFFC0340000", "m c #AB98FFFF0000", "M c #EE60F8DD0000", "N c #EB3FCD9639A6", "B c #88B9829A5243", "V c #923E8CD75BFD", "C c #B8AAA66841D2", "Z c #AB8CA2115E2D", "A c #829A810D6387", "S c #8D938EBC79A7", "D c #A1169F7F7D0A", "F c #B603B2E67CDB", "G c #D6EAA2E74CCA", "H c #DFA9A5D259EA", "J c #E2FAC96A42AC", "K c #FCB0E0274A79", "L c #D0B4C550624E", "P c #D2CBC66371E3", "I c #FFFFCBC7657C", "U c #E7DDDB5B6354", "Y c #FCA0F1E57CD0", "T c #155C06E9B2EC", "R c #172608ECB29F", "E c #19930B6FB493", "W c #19880AB1BBD6", "Q c #21A61417B641", "! 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[ Andreas Tille ] * debian/upstream: - Use more BibTeX friendly syntax for authors - Differentiate between URL and eprint -- Daniel Leidert (dale) Tue, 15 May 2012 22:28:54 +0200 shelxle (1.0.548-1) unstable; urgency=low * New upstream release. * debian/upstream: New file with bibliographic information. -- Daniel Leidert (dale) Tue, 03 Apr 2012 01:03:16 +0200 shelxle (1.0.544-1) unstable; urgency=low * New upstream release. * debian/control (Standards-Version): Bumped to 3.9.3. -- Daniel Leidert (dale) Tue, 20 Mar 2012 23:15:24 +0100 shelxle (1.0.540-1) unstable; urgency=low * New upstream release. -- Daniel Leidert (dale) Mon, 20 Feb 2012 20:33:10 +0100 shelxle (1.0.537-1) unstable; urgency=low * New upstream release. * debian/shelxle.1: Update. * debian/patches/disable_update_search.patch: Added. - Disable the automatic update search. * debian/patches/series: Added. -- Daniel Leidert (dale) Wed, 15 Feb 2012 19:46:06 +0100 shelxle (1.0.513-1) unstable; urgency=low * Initial packaging (closes: #654964). -- Daniel Leidert (dale) Sat, 07 Jan 2012 21:51:22 +0100 debian/control0000644000000000000000000000177612252707160010606 0ustar Source: shelxle Section: science Priority: optional Maintainer: Debichem Team Uploaders: Daniel Leidert Build-Depends: debhelper (>> 9), libfftw3-dev, libqt4-dev, libqt4-opengl-dev, libqtwebkit-dev, qt4-qmake Standards-Version: 3.9.5 Homepage: http://ewald.ac.chemie.uni-goettingen.de/shelx/ Vcs-Browser: http://anonscm.debian.org/viewvc/debichem/unstable/shelxle/ Vcs-Svn: svn://anonscm.debian.org/debichem/unstable/shelxle/ Package: shelxle Architecture: any Depends: ${misc:Depends}, ${shlibs:Depends} Description: graphical user interface for SHELXL ShelXle combines an editor with syntax highlighting for the SHELXL-associated .ins (input) and .res (output) files with an interactive graphical display for visualization of a three-dimensional structure including the electron density (Fo) and difference density (Fo-Fc) maps. . http://dx.doi.org/10.1107/S0021889811043202 debian/compat0000644000000000000000000000000211771132660010370 0ustar 9 debian/shelxle.menu0000644000000000000000000000030611716773401011526 0ustar ?package(shelxle):\ needs="X11"\ section="Applications/Science/Chemistry"\ title="ShelXle" longtitle="Qt GUI for SHELXL"\ icon="/usr/share/pixmaps/shelxle.xpm"\ command="/usr/bin/shelxle" debian/shelxle.doc-base0000644000000000000000000000071111773371425012242 0ustar Document: shelxle Title: ShelXle - A Qt GUI for SHELXL Author: Christian B. Hübschle Abstract: ShelXle combines an editor with syntax highlighting for SHELXL-associated files with an interactive graphical display for visualization of a three-dimensional structure including the electron density and difference density maps. Section: Science/Chemistry Format: HTML Index: /usr/share/doc/shelxle/help/index.html Files: /usr/share/doc/shelxle/help/*.html