Date: Thu, 30 Oct 2008 10:32:58 GMT From: fulvio ciriaco <oivulf@gmail.com> To: freebsd-gnats-submit@FreeBSD.org Subject: ports/128476: update molden port Message-ID: <200810301032.m9UAWw1o036694@www.freebsd.org> Resent-Message-ID: <200810301040.m9UAe1IF079715@freefall.freebsd.org>
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>Number: 128476 >Category: ports >Synopsis: update molden port >Confidential: no >Severity: non-critical >Priority: low >Responsible: freebsd-ports-bugs >State: open >Quarter: >Keywords: >Date-Required: >Class: update >Submitter-Id: current-users >Arrival-Date: Thu Oct 30 10:40:01 UTC 2008 >Closed-Date: >Last-Modified: >Originator: fulvio ciriaco >Release: 7.1 >Organization: >Environment: FreeBSD fulvio.ciriaco 7.1-PRERELEASE-p1 FreeBSD 7.1-PRERELEASE-p1 #0: Sun Oct 5 12:15:12 UTC 2008 root@i386-builder.daemonology.net:/usr/obj/usr/src/sys/GENERIC i386 >Description: molden in ports is 2 years old. Attached find a port updated to 4.7 Fulvio >How-To-Repeat: >Fix: Patch attached with submission follows: # This is a shell archive. Save it in a file, remove anything before # this line, and then unpack it by entering "sh file". Note, it may # create directories; files and directories will be owned by you and # have default permissions. # # This archive contains: # # molden # molden/files # molden/files/patch-ambfor-makefile # molden/files/patch-makefile # molden/files/patch-surf-makefile # molden/OLD-DIRS # molden/Makefile # molden/distinfo # molden/pkg-descr # molden/pkg-plist # echo c - molden mkdir -p molden > /dev/null 2>&1 echo c - molden/files mkdir -p molden/files > /dev/null 2>&1 echo x - molden/files/patch-ambfor-makefile sed 's/^X//' >molden/files/patch-ambfor-makefile << 'b762150fb3477896f4c1f38c465385e3' X--- ambfor/makefile.orig 2008-10-30 10:06:37.000000000 +0100 X+++ ambfor/makefile 2008-10-30 10:07:19.000000000 +0100 X@@ -14,11 +14,11 @@ X # X #CC = cc X X-CFLAGS = -c X-FC = g77 X+CFLAGS += -DFREEBSD=1 X+#FC = g77 X FFLAGS = -c -O3 -ffast-math X LIBS = -lm X-LDR = g77 X+LDR = $(FC) X X OBJS = ambfor.o angle.o bond.o charge.o conn.o enegrd.o getinp.o \ X param.o tors.o vdwlj.o math.o optimise.o wrtout.o b762150fb3477896f4c1f38c465385e3 echo x - molden/files/patch-makefile sed 's/^X//' >molden/files/patch-makefile << '6db492ab50031223ca046501db721e16' X--- makefile.orig 2008-08-25 19:55:57.000000000 +0200 X+++ makefile 2008-10-30 09:24:39.000000000 +0100 X@@ -12,9 +12,27 @@ X # X # Disregard compiler warnings on rdmolf.f X # X-CC = cc X+#CC = cc X LIBS = -lX11 -lm X-LIBSG = -L/usr/X11R6/lib -lGLU -lGL -lXmu -lX11 -lm X+LIBSG = -L${LOCALBASE}/lib -lGLU -lGL -lXmu -lX11 -lm X+ X+### X+# FreeBSD X+#CC = gcc X+CFLAGS += -c -DDOBACK -DHASTIMER -I${LOCALBASE}/include X+#FC = f77 X+.if ${MACHINE_ARCH} == i386 X+FFLAGS += -malign-double X+CFLAGS += -malign-double X+.endif X+.if ${OSVERSION} < 400005 X+FFLAGS += -Nn802 -Nx400 X+.else X+FFLAGS += #-Wno-globals -fno-globals X+.endif X+LIBS = -L${LOCALBASE}/lib -lX11 -lm X+LDR = ${FC} X+### X X # Silicon Graphics X #CFLAGS = -c -DDOBACK -DHASTIMER -DCOLOR_OFFSET=0.0 X@@ -52,11 +70,11 @@ X # with GCC4.0 or higher replace the line with: X # 'external gfortran_iargc' X # X-CFLAGS = -c -I/usr/X11R6/include -DDOBACK -DHASTIMER -DCOLOR_OFFSET=0.0 X-FC = g77 X-FFLAGS = X-LIBS = -L/usr/X11R6/lib -lX11 -lm X-LDR = g77 X+#CFLAGS = -c -I/usr/X11R6/include -DDOBACK -DHASTIMER -DCOLOR_OFFSET=0.0 X+#FC = g77 X+#FFLAGS = X+#LIBS = -L/usr/X11R6/lib -lX11 -lm X+#LDR = g77 X # 64 bit machines: X #LIBS = -L/usr/X11R6/lib64 -lX11 -lm X # X@@ -191,7 +209,7 @@ X # and the full opengl version of molden 'gmolden', (does not need glut) X # (make gmolden) X # X-LIBSOGL = -lglut -lGLU -lGL -lXmu -lX11 -lm X+LIBSOGL = -L${LOCALBASE}/lib -lglut -lGLU -lGL -lXmu -lX11 -lm X # X # on linux : X # X@@ -227,7 +245,7 @@ X $(MAKE) -C ambfor X X surf/surf: surf/*.h surf/*.c X- $(MAKE) -C surf depend X+# $(MAKE) -C surf depend X $(MAKE) -C surf X X # noxwin will not work as long as the old ocglbck calls arent in dummys 6db492ab50031223ca046501db721e16 echo x - molden/files/patch-surf-makefile sed 's/^X//' >molden/files/patch-surf-makefile << '8d8934f5e39e6dd80e8c6a3fd5893d0d' X--- surf/Makefile.orig 2008-10-30 10:12:27.000000000 +0100 X+++ surf/Makefile 2008-10-30 10:08:43.000000000 +0100 X@@ -63,46 +63,120 @@ X # DO NOT DELETE THIS LINE -- make depend depends on it. X X X-# DO NOT DELETE THIS LINE -- make depend depends on it. X+# DO NOT DELETE X X-surf.o: surf.h /usr/include/stdio.h /usr/include/math.h /usr/include/stdlib.h X-surf.o: /usr/include/sgidefs.h /usr/include/string.h /usr/include/sys/time.h X-surf.o: linalg.h X-io.o: surf.h /usr/include/stdio.h /usr/include/math.h /usr/include/stdlib.h X-io.o: /usr/include/sgidefs.h /usr/include/string.h /usr/include/sys/time.h X-io.o: linalg.h X-compute.o: surf.h /usr/include/stdio.h /usr/include/math.h X-compute.o: /usr/include/stdlib.h /usr/include/sgidefs.h /usr/include/string.h X-compute.o: /usr/include/sys/time.h linalg.h chull.h dual.h X-dual.o: surf.h /usr/include/stdio.h /usr/include/math.h /usr/include/stdlib.h X-dual.o: /usr/include/sgidefs.h /usr/include/string.h /usr/include/sys/time.h X-dual.o: linalg.h dual.h chull.h X-utils.o: surf.h /usr/include/stdio.h /usr/include/math.h X-utils.o: /usr/include/stdlib.h /usr/include/sgidefs.h /usr/include/string.h X-utils.o: /usr/include/sys/time.h linalg.h X-lp.o: surf.h /usr/include/stdio.h /usr/include/math.h /usr/include/stdlib.h X-lp.o: /usr/include/sgidefs.h /usr/include/string.h /usr/include/sys/time.h X-lp.o: linalg.h X-chull.o: surf.h /usr/include/stdio.h /usr/include/math.h X-chull.o: /usr/include/stdlib.h /usr/include/sgidefs.h /usr/include/string.h X-chull.o: /usr/include/sys/time.h linalg.h chull.h X-tessel_cases.o: surf.h /usr/include/stdio.h /usr/include/math.h X-tessel_cases.o: /usr/include/stdlib.h /usr/include/sgidefs.h X-tessel_cases.o: /usr/include/string.h /usr/include/sys/time.h linalg.h dual.h X-tessel_patches.o: surf.h /usr/include/stdio.h /usr/include/math.h X-tessel_patches.o: /usr/include/stdlib.h /usr/include/sgidefs.h X-tessel_patches.o: /usr/include/string.h /usr/include/sys/time.h linalg.h X-tessel_convex.o: surf.h /usr/include/stdio.h /usr/include/math.h X-tessel_convex.o: /usr/include/stdlib.h /usr/include/sgidefs.h X-tessel_convex.o: /usr/include/string.h /usr/include/sys/time.h linalg.h X-tessel_concave.o: surf.h /usr/include/stdio.h /usr/include/math.h X-tessel_concave.o: /usr/include/stdlib.h /usr/include/sgidefs.h X-tessel_concave.o: /usr/include/string.h /usr/include/sys/time.h linalg.h X-tessel_torus.o: surf.h /usr/include/stdio.h /usr/include/math.h X-tessel_torus.o: /usr/include/stdlib.h /usr/include/sgidefs.h X-tessel_torus.o: /usr/include/string.h /usr/include/sys/time.h linalg.h X- X-# DEPENDENCIES MUST END AT END OF FILE X-# IF YOU PUT STUFF HERE IT WILL GO AWAY X-# see make depend above X- X+surf.o: surf.h /usr/include/stdio.h /usr/include/sys/cdefs.h X+surf.o: /usr/include/sys/_null.h /usr/include/sys/_types.h X+surf.o: /usr/include/machine/_types.h /usr/include/math.h X+surf.o: /usr/include/machine/_limits.h /usr/include/stdlib.h X+surf.o: /usr/include/string.h /usr/include/strings.h /usr/include/sys/time.h X+surf.o: /usr/include/sys/_timeval.h /usr/include/sys/types.h X+surf.o: /usr/include/machine/endian.h /usr/include/sys/_pthreadtypes.h X+surf.o: /usr/include/sys/select.h /usr/include/sys/_sigset.h X+surf.o: /usr/include/sys/timespec.h /usr/include/time.h linalg.h X+io.o: surf.h /usr/include/stdio.h /usr/include/sys/cdefs.h X+io.o: /usr/include/sys/_null.h /usr/include/sys/_types.h X+io.o: /usr/include/machine/_types.h /usr/include/math.h X+io.o: /usr/include/machine/_limits.h /usr/include/stdlib.h X+io.o: /usr/include/string.h /usr/include/strings.h /usr/include/sys/time.h X+io.o: /usr/include/sys/_timeval.h /usr/include/sys/types.h X+io.o: /usr/include/machine/endian.h /usr/include/sys/_pthreadtypes.h X+io.o: /usr/include/sys/select.h /usr/include/sys/_sigset.h X+io.o: /usr/include/sys/timespec.h /usr/include/time.h linalg.h X+compute.o: surf.h /usr/include/stdio.h /usr/include/sys/cdefs.h X+compute.o: /usr/include/sys/_null.h /usr/include/sys/_types.h X+compute.o: /usr/include/machine/_types.h /usr/include/math.h X+compute.o: /usr/include/machine/_limits.h /usr/include/stdlib.h X+compute.o: /usr/include/string.h /usr/include/strings.h X+compute.o: /usr/include/sys/time.h /usr/include/sys/_timeval.h X+compute.o: /usr/include/sys/types.h /usr/include/machine/endian.h X+compute.o: /usr/include/sys/_pthreadtypes.h /usr/include/sys/select.h X+compute.o: /usr/include/sys/_sigset.h /usr/include/sys/timespec.h X+compute.o: /usr/include/time.h linalg.h chull.h dual.h X+dual.o: surf.h /usr/include/stdio.h /usr/include/sys/cdefs.h X+dual.o: /usr/include/sys/_null.h /usr/include/sys/_types.h X+dual.o: /usr/include/machine/_types.h /usr/include/math.h X+dual.o: /usr/include/machine/_limits.h /usr/include/stdlib.h X+dual.o: /usr/include/string.h /usr/include/strings.h /usr/include/sys/time.h X+dual.o: /usr/include/sys/_timeval.h /usr/include/sys/types.h X+dual.o: /usr/include/machine/endian.h /usr/include/sys/_pthreadtypes.h X+dual.o: /usr/include/sys/select.h /usr/include/sys/_sigset.h X+dual.o: /usr/include/sys/timespec.h /usr/include/time.h linalg.h dual.h X+dual.o: chull.h X+utils.o: surf.h /usr/include/stdio.h /usr/include/sys/cdefs.h X+utils.o: /usr/include/sys/_null.h /usr/include/sys/_types.h X+utils.o: /usr/include/machine/_types.h /usr/include/math.h X+utils.o: /usr/include/machine/_limits.h /usr/include/stdlib.h X+utils.o: /usr/include/string.h /usr/include/strings.h /usr/include/sys/time.h X+utils.o: /usr/include/sys/_timeval.h /usr/include/sys/types.h X+utils.o: /usr/include/machine/endian.h /usr/include/sys/_pthreadtypes.h X+utils.o: /usr/include/sys/select.h /usr/include/sys/_sigset.h X+utils.o: /usr/include/sys/timespec.h /usr/include/time.h linalg.h X+lp.o: surf.h /usr/include/stdio.h /usr/include/sys/cdefs.h X+lp.o: /usr/include/sys/_null.h /usr/include/sys/_types.h X+lp.o: /usr/include/machine/_types.h /usr/include/math.h X+lp.o: /usr/include/machine/_limits.h /usr/include/stdlib.h X+lp.o: /usr/include/string.h /usr/include/strings.h /usr/include/sys/time.h X+lp.o: /usr/include/sys/_timeval.h /usr/include/sys/types.h X+lp.o: /usr/include/machine/endian.h /usr/include/sys/_pthreadtypes.h X+lp.o: /usr/include/sys/select.h /usr/include/sys/_sigset.h X+lp.o: /usr/include/sys/timespec.h /usr/include/time.h linalg.h X+chull.o: surf.h /usr/include/stdio.h /usr/include/sys/cdefs.h X+chull.o: /usr/include/sys/_null.h /usr/include/sys/_types.h X+chull.o: /usr/include/machine/_types.h /usr/include/math.h X+chull.o: /usr/include/machine/_limits.h /usr/include/stdlib.h X+chull.o: /usr/include/string.h /usr/include/strings.h /usr/include/sys/time.h X+chull.o: /usr/include/sys/_timeval.h /usr/include/sys/types.h X+chull.o: /usr/include/machine/endian.h /usr/include/sys/_pthreadtypes.h X+chull.o: /usr/include/sys/select.h /usr/include/sys/_sigset.h X+chull.o: /usr/include/sys/timespec.h /usr/include/time.h linalg.h chull.h X+tessel_cases.o: surf.h /usr/include/stdio.h /usr/include/sys/cdefs.h X+tessel_cases.o: /usr/include/sys/_null.h /usr/include/sys/_types.h X+tessel_cases.o: /usr/include/machine/_types.h /usr/include/math.h X+tessel_cases.o: /usr/include/machine/_limits.h /usr/include/stdlib.h X+tessel_cases.o: /usr/include/string.h /usr/include/strings.h X+tessel_cases.o: /usr/include/sys/time.h /usr/include/sys/_timeval.h X+tessel_cases.o: /usr/include/sys/types.h /usr/include/machine/endian.h X+tessel_cases.o: /usr/include/sys/_pthreadtypes.h /usr/include/sys/select.h X+tessel_cases.o: /usr/include/sys/_sigset.h /usr/include/sys/timespec.h X+tessel_cases.o: /usr/include/time.h linalg.h dual.h X+tessel_patches.o: surf.h /usr/include/stdio.h /usr/include/sys/cdefs.h X+tessel_patches.o: /usr/include/sys/_null.h /usr/include/sys/_types.h X+tessel_patches.o: /usr/include/machine/_types.h /usr/include/math.h X+tessel_patches.o: /usr/include/machine/_limits.h /usr/include/stdlib.h X+tessel_patches.o: /usr/include/string.h /usr/include/strings.h X+tessel_patches.o: /usr/include/sys/time.h /usr/include/sys/_timeval.h X+tessel_patches.o: /usr/include/sys/types.h /usr/include/machine/endian.h X+tessel_patches.o: /usr/include/sys/_pthreadtypes.h /usr/include/sys/select.h X+tessel_patches.o: /usr/include/sys/_sigset.h /usr/include/sys/timespec.h X+tessel_patches.o: /usr/include/time.h linalg.h X+tessel_convex.o: surf.h /usr/include/stdio.h /usr/include/sys/cdefs.h X+tessel_convex.o: /usr/include/sys/_null.h /usr/include/sys/_types.h X+tessel_convex.o: /usr/include/machine/_types.h /usr/include/math.h X+tessel_convex.o: /usr/include/machine/_limits.h /usr/include/stdlib.h X+tessel_convex.o: /usr/include/string.h /usr/include/strings.h X+tessel_convex.o: /usr/include/sys/time.h /usr/include/sys/_timeval.h X+tessel_convex.o: /usr/include/sys/types.h /usr/include/machine/endian.h X+tessel_convex.o: /usr/include/sys/_pthreadtypes.h /usr/include/sys/select.h X+tessel_convex.o: /usr/include/sys/_sigset.h /usr/include/sys/timespec.h X+tessel_convex.o: /usr/include/time.h linalg.h X+tessel_concave.o: surf.h /usr/include/stdio.h /usr/include/sys/cdefs.h X+tessel_concave.o: /usr/include/sys/_null.h /usr/include/sys/_types.h X+tessel_concave.o: /usr/include/machine/_types.h /usr/include/math.h X+tessel_concave.o: /usr/include/machine/_limits.h /usr/include/stdlib.h X+tessel_concave.o: /usr/include/string.h /usr/include/strings.h X+tessel_concave.o: /usr/include/sys/time.h /usr/include/sys/_timeval.h X+tessel_concave.o: /usr/include/sys/types.h /usr/include/machine/endian.h X+tessel_concave.o: /usr/include/sys/_pthreadtypes.h /usr/include/sys/select.h X+tessel_concave.o: /usr/include/sys/_sigset.h /usr/include/sys/timespec.h X+tessel_concave.o: /usr/include/time.h linalg.h X+tessel_torus.o: surf.h /usr/include/stdio.h /usr/include/sys/cdefs.h X+tessel_torus.o: /usr/include/sys/_null.h /usr/include/sys/_types.h X+tessel_torus.o: /usr/include/machine/_types.h /usr/include/math.h X+tessel_torus.o: /usr/include/machine/_limits.h /usr/include/stdlib.h X+tessel_torus.o: /usr/include/string.h /usr/include/strings.h X+tessel_torus.o: /usr/include/sys/time.h /usr/include/sys/_timeval.h X+tessel_torus.o: /usr/include/sys/types.h /usr/include/machine/endian.h X+tessel_torus.o: /usr/include/sys/_pthreadtypes.h /usr/include/sys/select.h X+tessel_torus.o: /usr/include/sys/_sigset.h /usr/include/sys/timespec.h X+tessel_torus.o: /usr/include/time.h linalg.h 8d8934f5e39e6dd80e8c6a3fd5893d0d echo x - molden/OLD-DIRS sed 's/^X//' >molden/OLD-DIRS << '6c77c3ef309d772cb96f66ef2891eb91' Xbin Xetc Xetc/pam.d Xetc/rc.d Xinclude Xinclude/X11 Xinfo Xlib Xlib/X11 Xlib/X11/app-defaults Xlib/X11/fonts Xlib/X11/fonts/local Xlibdata Xlibdata/ldconfig Xlibdata/ldconfig32 Xlibdata/pkgconfig Xlibexec Xman Xman/cat1 Xman/cat2 Xman/cat3 Xman/cat4 Xman/cat5 Xman/cat6 Xman/cat7 Xman/cat8 Xman/cat9 Xman/catl Xman/catn Xman/de.ISO8859-1 Xman/de.ISO8859-1/cat1 Xman/de.ISO8859-1/cat2 Xman/de.ISO8859-1/cat3 Xman/de.ISO8859-1/cat4 Xman/de.ISO8859-1/cat5 Xman/de.ISO8859-1/cat6 Xman/de.ISO8859-1/cat7 Xman/de.ISO8859-1/cat8 Xman/de.ISO8859-1/cat9 Xman/de.ISO8859-1/catl Xman/de.ISO8859-1/catn Xman/de.ISO8859-1/man1 Xman/de.ISO8859-1/man2 Xman/de.ISO8859-1/man3 Xman/de.ISO8859-1/man4 Xman/de.ISO8859-1/man5 Xman/de.ISO8859-1/man6 Xman/de.ISO8859-1/man7 Xman/de.ISO8859-1/man8 Xman/de.ISO8859-1/man9 Xman/de.ISO8859-1/manl Xman/de.ISO8859-1/mann Xman/en.ISO8859-1 Xman/en.ISO8859-1/cat1 Xman/en.ISO8859-1/cat1aout Xman/en.ISO8859-1/cat2 Xman/en.ISO8859-1/cat3 Xman/en.ISO8859-1/cat4 Xman/en.ISO8859-1/cat4/i386 Xman/en.ISO8859-1/cat5 Xman/en.ISO8859-1/cat6 Xman/en.ISO8859-1/cat7 Xman/en.ISO8859-1/cat8 Xman/en.ISO8859-1/cat8/i386 Xman/en.ISO8859-1/cat9 Xman/en.ISO8859-1/cat9/i386 Xman/en.ISO8859-1/catn Xman/ja Xman/ja/cat1 Xman/ja/cat2 Xman/ja/cat3 Xman/ja/cat4 Xman/ja/cat5 Xman/ja/cat6 Xman/ja/cat7 Xman/ja/cat8 Xman/ja/cat9 Xman/ja/catl Xman/ja/catn Xman/ja/man1 Xman/ja/man2 Xman/ja/man3 Xman/ja/man4 Xman/ja/man5 Xman/ja/man6 Xman/ja/man7 Xman/ja/man8 Xman/ja/man9 Xman/ja/manl Xman/ja/mann Xman/man1 Xman/man2 Xman/man3 Xman/man4 Xman/man5 Xman/man6 Xman/man7 Xman/man8 Xman/man9 Xman/manl Xman/mann 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Xshare/nls/ro_RO.UTF-8 Xshare/nls/ru_RU.CP1251 Xshare/nls/ru_RU.CP866 Xshare/nls/ru_RU.ISO8859-5 Xshare/nls/ru_RU.KOI8-R Xshare/nls/ru_RU.UTF-8 Xshare/nls/sk_SK.ISO8859-2 Xshare/nls/sk_SK.UTF-8 Xshare/nls/sl_SI.ISO8859-2 Xshare/nls/sl_SI.UTF-8 Xshare/nls/sr_YU.ISO8859-2 Xshare/nls/sr_YU.ISO8859-5 Xshare/nls/sr_YU.UTF-8 Xshare/nls/sv_SE.ISO8859-1 Xshare/nls/sv_SE.ISO8859-15 Xshare/nls/sv_SE.UTF-8 Xshare/nls/tr_TR.ISO8859-9 Xshare/nls/tr_TR.UTF-8 Xshare/nls/uk_UA.ISO8859-5 Xshare/nls/uk_UA.KOI8-U Xshare/nls/uk_UA.UTF-8 Xshare/nls/zh_CN.GB18030 Xshare/nls/zh_CN.GB2312 Xshare/nls/zh_CN.GBK Xshare/nls/zh_CN.UTF-8 Xshare/nls/zh_CN.eucCN Xshare/nls/zh_HK.Big5HKSCS Xshare/nls/zh_HK.UTF-8 Xshare/nls/zh_TW.Big5 Xshare/nls/zh_TW.UTF-8 Xshare/pixmaps Xshare/sgml Xshare/skel Xshare/xml Xwww 6c77c3ef309d772cb96f66ef2891eb91 echo x - molden/Makefile sed 's/^X//' >molden/Makefile << 'b9ef21f1ab8e3e8cc836c1ba5cf84814' X# New ports collection makefile for: molden X# Date created: 1998-11-14 X# Whom: rmiya X# X# $FreeBSD: ports/biology/molden/Makefile,v 1.37 2008/08/15 17:42:47 bsam Exp $ X# X XPORTNAME= molden XPORTVERSION= 4.7 XCATEGORIES= biology XMASTER_SITES= ftp://ftp.cmbi.kun.nl/pub/molgraph/molden/ XDISTNAME= ${PORTNAME}${PORTVERSION} XEXTRACT_SUFX= .tar.gz XDIST_SUBDIR= ${PKGNAME} X#EXTRACT_ONLY= ${PORTNAME}${PORTVERSION}.tar.Z X XMAINTAINER= ports@FreeBSD.org XCOMMENT= Display molecular orbitals and electron densities in 2D and 3D X XUSE_XORG= x11 xmu XUSE_GL= glut X XRESTRICTED= free for academic, non profit usage; do not re-distribute source and executable. XMAKEFILE= ${WRKSRC}/makefile X X.include <bsd.port.pre.mk> X XUSE_FORTRAN= yes X Xpost-patch: X ${REINPLACE_CMD} -e 's,malloc.h,stdlib.h,' ${WRKSRC}/xwin.c X Xpost-configure: X @${ECHO_MSG} "********************" X @${ECHO_MSG} "** If you want to use a larger MOLDEN," X @${ECHO_MSG} "** edit change_parameter.sh and run it," X @${ECHO_MSG} "** before \'make build\'." X @${ECHO_MSG} "********************" X Xdo-install: X ${INSTALL_PROGRAM} ${WRKSRC}/molden ${PREFIX}/bin X ${INSTALL_PROGRAM} ${WRKSRC}/ambfor/ambfor ${PREFIX}/bin X ${INSTALL_PROGRAM} ${WRKSRC}/gmolden ${PREFIX}/bin X ${INSTALL_PROGRAM} ${WRKSRC}/surf/surf ${PREFIX}/bin X.if !defined(NOPORTDOCS) X ${MKDIR} ${PREFIX}/share/doc/molden X ${MKDIR} ${PREFIX}/share/molden/test X ${MKDIR} ${PREFIX}/share/molden/utils X ${INSTALL_DATA} ${WRKSRC}/doc/* ${PREFIX}/share/doc/molden X ${INSTALL_DATA} ${WRKSRC}/test/* ${PREFIX}/share/molden/test X ${INSTALL_DATA} ${WRKSRC}/utils/* ${PREFIX}/share/molden/utils X.endif X X.include <bsd.port.post.mk> b9ef21f1ab8e3e8cc836c1ba5cf84814 echo x - molden/distinfo sed 's/^X//' >molden/distinfo << 'bd9b5042ebf88c8b8242b772bad6d72e' XMD5 (molden-4.7/molden4.7.tar.gz) = eb0c287b59e5b5d5f48acad3f25c489c XSHA256 (molden-4.7/molden4.7.tar.gz) = 0af3f60235f57cf229078d478943878ac4162a5cb948f396c014d5d1ef1f8111 XSIZE (molden-4.7/molden4.7.tar.gz) = 2814376 bd9b5042ebf88c8b8242b772bad6d72e echo x - molden/pkg-descr sed 's/^X//' >molden/pkg-descr << '6139a2189cf04c6ebf49064b59045a78' XVisualizing the results of molecular orbital calculations X 1) MO program: gaussian, gamess, mopac, etc. X 2) display molecule in 3D: geo-opt, single-point, nomal mode (animation) X 3) density: contour plot or 3D view for electron density and MO coefficient XEverything what you want about MO calculation can be seen. X XWWW: http://www.cmbi.kun.nl/~schaft/molden/molden.html X XBy the distribution policy of the author; X * Only the latest version is supplied. X * Users must get the `distfiles' from the original site. X * Do not re-distribute the source and the executable. X * Using a not-so-latest version is prohibited, because X the author may only respond about the latest version. X X-- Xrmiya 6139a2189cf04c6ebf49064b59045a78 echo x - molden/pkg-plist sed 's/^X//' >molden/pkg-plist << '8ddecc3096f97e67d920b727dbed687c' Xbin/ambfor Xbin/gmolden Xbin/molden Xbin/surf Xshare/doc/molden/figures.ps.Z Xshare/doc/molden/manual.ps.Z Xshare/doc/molden/manual.txt.Z Xshare/molden/test/adf.molf Xshare/molden/test/ambfor_amber.xyz Xshare/molden/test/ambfor_gaff.xyz Xshare/molden/test/ampac.arc Xshare/molden/test/ampac.test Xshare/molden/test/bucky.xyz Xshare/molden/test/chemx.test Xshare/molden/test/complex2.out Xshare/molden/test/cpeptide.gro Xshare/molden/test/esp.test Xshare/molden/test/esp.txt Xshare/molden/test/esp.xyz Xshare/molden/test/fragment Xshare/molden/test/gamess_uk.freq Xshare/molden/test/gamess_uk.input Xshare/molden/test/gamess_uk.test1 Xshare/molden/test/gamess_uk.test2 Xshare/molden/test/gamess_us.h2o_631g_opt.out Xshare/molden/test/gamess_us.irc Xshare/molden/test/gamess_us_uhf_opt Xshare/molden/test/gaussian.freq Xshare/molden/test/gaussian.input Xshare/molden/test/gaussian.test Xshare/molden/test/jaguar.cube Xshare/molden/test/molden.ogl Xshare/molden/test/mopac.freq Xshare/molden/test/mopac.test Xshare/molden/test/pdb.test Xshare/molden/test/pdb.test.omap Xshare/molden/test/qchem.test Xshare/molden/test/reacpth.xyz Xshare/molden/test/shelx.ins Xshare/molden/test/surface.molf Xshare/molden/test/test.fdat Xshare/molden/test/test.mol2 Xshare/molden/test/test_homo.cube Xshare/molden/test/tinker_charmm.xyz Xshare/molden/test/tinker_mm3.xyz Xshare/molden/test/uracil.fdat Xshare/molden/test/uracil_gauss.out Xshare/molden/test/vamp.test Xshare/molden/utils/INFO Xshare/molden/utils/ch_backspace Xshare/molden/utils/ch_mxcon Xshare/molden/utils/ch_par Xshare/molden/utils/colors Xshare/molden/utils/ircextract.awk Xshare/molden/utils/molden Xshare/molden/utils/multi_vrml.csh Xshare/molden/utils/multi_vrml_orbitals.csh X@dirrm share/molden/utils X@dirrm share/molden/test X@dirrm share/molden X@dirrm share/doc/molden 8ddecc3096f97e67d920b727dbed687c exit >Release-Note: >Audit-Trail: >Unformatted:
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