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authorjtb <jtb@pkgsrc.org>2003-08-30 21:10:11 +0000
committerjtb <jtb@pkgsrc.org>2003-08-30 21:10:11 +0000
commit43e842b1a14facc3b0a7c19b0f953e2e2ffe424c (patch)
tree3d0e72093522de1553a3888832bd61810dba5636 /biology
parentded376a5fea567a90e325f82b420d43b7538a4ad (diff)
downloadpkgsrc-43e842b1a14facc3b0a7c19b0f953e2e2ffe424c.tar.gz
Update to version 1.6.
New features in chemtool 1.6 - universal import mode based on BABEL (both openbabel and babel supported) - Formula weight calculator now handles all main group elements and the first row of transition elements, and accepts greek phi as phenyl substituent. - Movable hexagonal or square grid backdrop - Improved SVG export, optional preview bitmaps in EPS export, optional EMF export - Cursor key support for pixel-precise drawing and moving - The cleanup function now corrects bonds that deviate from ideal horizontal or vertical orientation by a single pixel - Color support (bonds and text can be red,green,blue,cyan,magenta or yellow). - Default bond length now configurable, additional grid positions at two and three times this length added - Added a brief help text to accompany the 'About' window in the 'Help' menu. - Added alternate text font (Times Roman) - An attachment site can be marked before saving a molecule or fragment, which act as reference point for adding this fragment to other molecules (previously, this had to be the first atom in a file). Attachment sites are marked in the preview window by a small x. - Background color can now be chosen for screen display and EPS export, and drawing whiteout boxes under labels is now an option ( off by default !). - Text at 8,10,12,14,17,20 and 24pt can now coexist in a drawing. - Increased allowed label length to 100. - Improved rendering of dashed wedge and dotted lines - Improved text kerning in xfig-based print and export. - It is now possible to place an auto-incrementing counter at the cursor position for numbering sites. - Changed double bond drawing code to no longer switch sides depending on drawing (or rotation) angle. (As a result of this, some older drawings will need fixing) - Rescaling a molecule now also scales its labels. Downscaling beyond zero size (causing strange inversions) is no longer possible. - Renamed the "Orbitals" template menu to "Symbols" and added "plus", "minus" and a rearrangement arrow to it. - Added two new bond types, a triple bond with all three lines equal, and a quadruple bond.
Diffstat (limited to 'biology')
-rw-r--r--biology/chemtool/Makefile17
-rw-r--r--biology/chemtool/PLIST27
-rw-r--r--biology/chemtool/distinfo11
-rw-r--r--biology/chemtool/patches/patch-aa61
-rw-r--r--biology/chemtool/patches/patch-ab12
-rw-r--r--biology/chemtool/patches/patch-ac10
-rw-r--r--biology/chemtool/patches/patch-ad8
7 files changed, 44 insertions, 102 deletions
diff --git a/biology/chemtool/Makefile b/biology/chemtool/Makefile
index bba405ad3ff..e1a94686766 100644
--- a/biology/chemtool/Makefile
+++ b/biology/chemtool/Makefile
@@ -1,17 +1,18 @@
-# $NetBSD: Makefile,v 1.18 2003/07/17 21:24:41 grant Exp $
+# $NetBSD: Makefile,v 1.19 2003/08/30 21:10:11 jtb Exp $
-DISTNAME= chemtool-1.4.1
-PKGREVISION= 2
+DISTNAME= chemtool-1.6
CATEGORIES= biology
-MASTER_SITES= http://www.uni-ulm.de/~s_tvolk/chemtool/src/
+MASTER_SITES= http://ruby.chemie.uni-freiburg.de/~martin/chemtool/
MAINTAINER= tech-pkg@NetBSD.org
-HOMEPAGE= http://www.uni-ulm.de/~s_tvolk/chemtool.html
+HOMEPAGE= http://ruby.chemie.uni-freiburg.de/~martin/chemtool/
COMMENT= Program for drawing organic molecules
-USE_BUILDLINK2= # defined
-USE_PKGLOCALEDIR= # defined
-USE_X11= # defined
+USE_BUILDLINK2= yes
+USE_PKGLOCALEDIR= yes
+USE_X11= yes
+GNU_CONFIGURE= yes
+USE_GMAKE= yes
post-install:
${INSTALL_DATA_DIR} ${PREFIX}/share/examples/chemtool
diff --git a/biology/chemtool/PLIST b/biology/chemtool/PLIST
index 97259005562..67b28475cff 100644
--- a/biology/chemtool/PLIST
+++ b/biology/chemtool/PLIST
@@ -1,38 +1,49 @@
-@comment $NetBSD: PLIST,v 1.3 2002/11/30 15:32:00 salo Exp $
+@comment $NetBSD: PLIST,v 1.4 2003/08/30 21:10:11 jtb Exp $
bin/chemtool
bin/cht
man/man1/chemtool.1
+man/man1/cht.1
share/doc/chemtool/README
share/doc/chemtool/TODO
+share/examples/chemtool/14263232.mol
share/examples/chemtool/AMP.cht
share/examples/chemtool/Adenosine.cht
share/examples/chemtool/Dehydrotubifolin.cht
+share/examples/chemtool/G-host.pdb
share/examples/chemtool/Indolizomycin.cht
share/examples/chemtool/Lepicidin-A-Aglycon.cht
-share/examples/chemtool/Neu1
share/examples/chemtool/Neu2
+share/examples/chemtool/amine.mol
+share/examples/chemtool/anabsinthin
+share/examples/chemtool/atp
+share/examples/chemtool/bcarotin.pdb
share/examples/chemtool/breve.cht
+share/examples/chemtool/breve.mol
+share/examples/chemtool/bufotalin
share/examples/chemtool/byrostatin1.cht
+share/examples/chemtool/c70.cht
share/examples/chemtool/camphor
+share/examples/chemtool/chlorophyll
share/examples/chemtool/claisen.cht
-share/examples/chemtool/example1
-share/examples/chemtool/example2
-share/examples/chemtool/example3
-share/examples/chemtool/example4
-share/examples/chemtool/example5
-share/examples/chemtool/example7
+share/examples/chemtool/dodecahedran.cht
share/examples/chemtool/indigo
+share/examples/chemtool/kdo
share/examples/chemtool/krebs.cht
+share/examples/chemtool/labeltest
+share/examples/chemtool/pagodan.cht
share/examples/chemtool/penicillin_v.cht
share/examples/chemtool/pteridin
share/examples/chemtool/reaction.cht
share/examples/chemtool/rutamycin_b.cht
+share/examples/chemtool/tbutylazulene
share/examples/chemtool/tcdd.cht
+share/examples/chemtool/tetracyclin
share/examples/chemtool/viagra.cht
${PKGLOCALEDIR}/locale/cs/LC_MESSAGES/chemtool.mo
${PKGLOCALEDIR}/locale/de/LC_MESSAGES/chemtool.mo
${PKGLOCALEDIR}/locale/fr/LC_MESSAGES/chemtool.mo
${PKGLOCALEDIR}/locale/pl/LC_MESSAGES/chemtool.mo
+${PKGLOCALEDIR}/locale/pt_BR/LC_MESSAGES/chemtool.mo
${PKGLOCALEDIR}/locale/ru/LC_MESSAGES/chemtool.mo
@dirrm share/examples/chemtool
@dirrm share/doc/chemtool
diff --git a/biology/chemtool/distinfo b/biology/chemtool/distinfo
index d026c80672f..7836f427c60 100644
--- a/biology/chemtool/distinfo
+++ b/biology/chemtool/distinfo
@@ -1,8 +1,5 @@
-$NetBSD: distinfo,v 1.7 2002/12/01 20:25:39 salo Exp $
+$NetBSD: distinfo,v 1.8 2003/08/30 21:10:11 jtb Exp $
-SHA1 (chemtool-1.4.1.tar.gz) = 03560d5bbc90e12032e80e5313fc257f3f0955d1
-Size (chemtool-1.4.1.tar.gz) = 150140 bytes
-SHA1 (patch-aa) = ff4fbfa2bd611ad4e91c598334436a9d982fef74
-SHA1 (patch-ab) = 258a7940f5a2135891f61c30f02c7c57b67aeaa2
-SHA1 (patch-ac) = 05d31454c8e1609ce406be54d8390defbbe35c1f
-SHA1 (patch-ad) = 26f3e4dc18c355185937c34cd7ec789d358d3a02
+SHA1 (chemtool-1.6.tar.gz) = 0560600bdc4a66b1fb9d5df68584a4a33c56b584
+Size (chemtool-1.6.tar.gz) = 358695 bytes
+SHA1 (patch-aa) = f1ee3192b7b162bbbe1c35728f8c5f440423219f
diff --git a/biology/chemtool/patches/patch-aa b/biology/chemtool/patches/patch-aa
index 3d414708cdb..28206adca68 100644
--- a/biology/chemtool/patches/patch-aa
+++ b/biology/chemtool/patches/patch-aa
@@ -1,50 +1,13 @@
-$NetBSD: patch-aa,v 1.9 2002/12/01 20:25:39 salo Exp $
+$NetBSD: patch-aa,v 1.10 2003/08/30 21:10:12 jtb Exp $
---- Makefile.orig Sat Sep 8 16:56:18 2001
-+++ Makefile Sat Nov 30 12:56:37 2002
-@@ -1,21 +1,10 @@
--PREFIX=/usr/local
--LOCALEDIR=/usr/share/locale
-+localedir=${PREFIX}/share/locale
-
--ifdef LOCALEDIR
--CFLAGS=-O2 -Wall `gtk-config --cflags` -DMENU -DLOCALEDIR=\"${LOCALEDIR}\"
--else
--CFLAGS=-O2 -Wall `gtk-config --cflags` -DMENU -DDISABLE_NLS
--endif
-+CFLAGS=-O2 -Wall `gtk-config --cflags` -DMENU -DLOCALEDIR=\"${localedir}\"
-
--CC=gcc
--CP=/bin/cp
--RM=/bin/rm -f
--MAKE=make
--
- SRCS = main.c chemproc.c graph.c draw.c inout.c
- OBJS = main.o chemproc.o graph.o draw.o inout.o
-
--
- SYS_LIBRARIES = `gtk-config --libs` -lm
-
- all: chemtool cht
-@@ -25,17 +14,13 @@
- chemtool: ${OBJS}
- ${CC} ${OBJS} ${SYS_LIBRARIES} -o chemtool
-
--cht: src-cht/cht-1.7.c
-+cht: src-cht/cht-1.8.c
- cd src-cht;${MAKE}
-
--
- install: chemtool src-cht/cht
-- ${CP} chemtool src-cht/cht ${PREFIX}/bin
-- ${CP} chemtool.1 ${PREFIX}/man/man1
-- ${CP} cht.1 ${PREFIX}/man/man1
-- ifdef LOCALEDIR
-- for L in `ls locales`; do ${CP} locales/$$L/chemtool.mo ${LOCALEDIR}/$$L/LC_MESSAGES;done
-- endif
-+ ${BSD_INSTALL_PROGRAM} chemtool src-cht/cht ${PREFIX}/bin
-+ ${BSD_INSTALL_MAN} chemtool.1 cht.1 ${PREFIX}/man/man1
-+ for L in `ls locales`; do ${BSD_INSTALL_DATA} locales/$$L/chemtool.mo ${localedir}/$$L/LC_MESSAGES;done
- clean:
- ${RM} *.o *~ src-cht/*.o src-cht/*~ chemtool src-cht/cht
-
+--- Makefile.in.orig 2003-08-19 19:24:28.000000000 +0100
++++ Makefile.in 2003-08-19 19:24:43.000000000 +0100
+@@ -5,7 +5,7 @@
+ mandir=@mandir@
+ kdedir=@kdemimedir@
+ gnomedir=@gnomemimedir@
+-CFLAGS=-O2 -Wall -Wunused -Wuninitialized -I. `gtk-config --cflags` @DEFS@ -DLOCALEDIR=\"${localedir}\"
++CFLAGS+=-Wall -Wunused -Wuninitialized -I. `gtk-config --cflags` @DEFS@ -DLOCALEDIR=\"${localedir}\"
+
+ CC=@CC@
+ CP=/bin/cp
diff --git a/biology/chemtool/patches/patch-ab b/biology/chemtool/patches/patch-ab
deleted file mode 100644
index 5f95ccfa88a..00000000000
--- a/biology/chemtool/patches/patch-ab
+++ /dev/null
@@ -1,12 +0,0 @@
-$NetBSD: patch-ab,v 1.3 2002/05/20 17:25:43 cjep Exp $
---- src-cht/cht-1.8.c.orig Mon Apr 29 10:21:47 2002
-+++ src-cht/cht-1.8.c Mon Apr 29 10:22:03 2002
-@@ -14,7 +14,7 @@
- * by the licence agreement accompanying p2c itself.
- */
-
--
-+#include <limits.h>
- #include <stdio.h>
- #include <unistd.h>
- #define DOUBLE double
diff --git a/biology/chemtool/patches/patch-ac b/biology/chemtool/patches/patch-ac
deleted file mode 100644
index 93090fd57be..00000000000
--- a/biology/chemtool/patches/patch-ac
+++ /dev/null
@@ -1,10 +0,0 @@
-$NetBSD: patch-ac,v 1.2 2002/05/03 22:03:08 jtb Exp $
-
---- src-cht/Makefile.orig Mon Apr 29 10:12:34 2002
-+++ src-cht/Makefile Mon Apr 29 10:12:59 2002
-@@ -1,4 +1,4 @@
- default: cht
-
- cht: cht-1.8.c
-- gcc -O cht-1.8.c -o cht
-+ $(CC) $(CFLAGS) cht-1.8.c -o cht -lm
diff --git a/biology/chemtool/patches/patch-ad b/biology/chemtool/patches/patch-ad
deleted file mode 100644
index bab1908503e..00000000000
--- a/biology/chemtool/patches/patch-ad
+++ /dev/null
@@ -1,8 +0,0 @@
-$NetBSD: patch-ad,v 1.2 2002/05/20 17:25:43 cjep Exp $
---- ct.h.orig Mon Apr 29 10:18:39 2002
-+++ ct.h Mon Apr 29 10:18:45 2002
-@@ -1,4 +1,3 @@
--#undef __GNUC__
- #include <stdio.h>
- #include <stdlib.h>
- #include <math.h>