Attachment 99573 Details for Bug 138673 – mol2ps.shar

mol2ps.shar

mol2ps.shar (text/plain), 5.16 KB, created by Fernan Aguero on 2009-09-09 19:10:01 UTC

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Creator: Fernan Aguero

Created: 2009-09-09 19:10:01 UTC

Size: 5.16 KB

patch

obsolete

># 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:
>#
>#	mol2ps
>#	mol2ps/Makefile
>#	mol2ps/distinfo
>#	mol2ps/pkg-descr
>#	mol2ps/files
>#	mol2ps/files/color.conf
>#
>echo c - mol2ps
>mkdir -p mol2ps > /dev/null 2>&1
>echo x - mol2ps/Makefile
>sed 's/^X//' >mol2ps/Makefile << 'f4b47c8a8f24d66abad1e19079b50e2e'
>X# New ports collection makefile for:	mol2ps
>X# Date created:		23 Feb 2009
>X# Whom:	      		Fernan Aguero <fernan@iib.unsam.edu.ar>
>X#
>X# $FreeBSD$
>X#
>X
>XPORTNAME=	mol2ps
>XPORTVERSION=	0.1e
>XCATEGORIES=	science
>XMASTER_SITES=	http://merian.pch.univie.ac.at/pch/download/chemistry/${PORTNAME}/
>XDISTNAME=	${PORTNAME}
>XEXTRACT_SUFX=	.pas
>X
>XMAINTAINER=	fernan@iib.unsam.edu.ar
>XCOMMENT=	Read molecular structure files and generate Postscript output
>X
>XUSE_FPC=	yes
>XPLIST_FILES=	bin/${PORTNAME} ${DATADIR}/color.conf
>X
>Xdo-extract:
>X	@${RM} -rf ${WRKDIR}
>X	@${MKDIR} ${WRKDIR}
>X	${CP} ${DISTDIR}/${DISTFILES} ${WRKDIR}/
>Xdo-build:
>X	cd ${WRKDIR}; ${LOCALBASE}/bin/fpc ${DISTFILES} -S2 -O3 -Op3
>Xdo-install:
>X	${INSTALL_PROGRAM} ${WRKDIR}/${PORTNAME} ${PREFIX}/bin/
>X	@${MKDIR} ${DATADIR}
>X	${INSTALL_DATA} ${FILESDIR}/color.conf ${DATADIR}
>X
>X.include <bsd.port.mk>
>f4b47c8a8f24d66abad1e19079b50e2e
>echo x - mol2ps/distinfo
>sed 's/^X//' >mol2ps/distinfo << '122cb6635c992881f31bc1a07336a57e'
>XMD5 (mol2ps.pas) = 9bc6475e8d54827dca10a9b9a1994d61
>XSHA256 (mol2ps.pas) = 9e8b46132b8d1f5baea08231c04dd5a3051c52b5ca8da5a38141753a1344506f
>XSIZE (mol2ps.pas) = 165111
>122cb6635c992881f31bc1a07336a57e
>echo x - mol2ps/pkg-descr
>sed 's/^X//' >mol2ps/pkg-descr << 'a54e2f3be3e38370cd9573388cd8a20a'
>Xmol2ps is a freely available command-line utility program which reads
>Xmolecular structure files in different formats and generates
>XPostscript output for 2D display. The Postscript file can then be used
>Xe.g. for creating a bitmap file, using a Postscript interpreter like
>XGhostscript.
>X
>XAs input files, MDL molfiles and SD files (*.mol, *.sdf; 2D and 3D),
>XAlchemy molfiles (*.mol), and Sybyl mol2 files (*.mol2) are accepted
>Xby mol2ps, the preferred format is the MDL molfile format. At present,
>Xit is not intended to extend the number of supported input file
>Xformats, as there are powerful file format converters available, such
>Xas OpenBabel (see biology/babel port).
>X
>XThe main purpose of mol2ps is to create small, but high-quality 2D
>Xpictures of molecules for display on web pages. Especially for
>Xweb-based molecular structure databases it is quite useful to have
>Xpre-built pictures for display in hitlists instead of invoking browser
>Xplugins, Java applets, or server-side programs for display of the
>Xindividual structures.
>X
>XWWW: http://merian.pch.univie.ac.at/~nhaider/cheminf/mol2ps.html
>a54e2f3be3e38370cd9573388cd8a20a
>echo c - mol2ps/files
>mkdir -p mol2ps/files > /dev/null 2>&1
>echo x - mol2ps/files/color.conf
>sed 's/^X//' >mol2ps/files/color.conf << 'c18d15373c5735c7a7780b7cbf62d6a6'
>XH   0 0 0                         
>XD   0 0 255
>XT   0 0 255
>XHe  255 51 204         
>XLi  102 0 0            
>XBe  0 204 102          
>XB   0 255 51           
>XC   255 0 51              
>XN   0 0 255            
>XO   204  51 0          
>XF   255 153 51         
>XNe  255 51 204
>XNa  0 0 255            
>XMg  51 102 51          
>XAl  153 153 153        
>XSi  255 153 51         
>XP   255 204 0          
>XS   255 204 51          
>XCl  0 255 51           
>XAr  255 51 204
>XK   255 51 204         
>XCa  153 153 153        
>XSc  255 51 204         
>XTi  255 51 204         
>XV   255 51 204         
>XCr  0 255 102          
>XMn  153 153 153        
>XFe  255 204 0          
>XCo  255 51 204         
>XNi  153 51 51          
>XCu  204 102 0          
>XZn  204 102 204        
>XGa  255 51 204
>XGe  255 51 204
>XAs  255 51 204
>XSe  255 51 204         
>XBr  204 102 0          
>XKr  255 51 204
>XRb  255 51 204         
>XSr  255 51 204
>XY   255 51 204
>XZr  255 51 204
>XNb  255 51 204
>XMo  255 51 204
>XTc  255 51 204
>XRu  255 51 204
>XRh  255 51 204
>XPd  255 51 204
>XAg  153 153 153
>XCd  255 51 204
>XIn  255 51 204
>XSn  255 51 204
>XSb  255 51 204
>XTe  255 51 204
>XI   255 0 204      
>XXe  255 51 204
>XCs  255 51 204      
>XBa  255 51 204
>XLu  255 51 204
>XHf  255 51 204
>XTa  255 51 204
>XW   255 51 204
>XRe  255 51 204
>XOs  255 51 204
>XIr  255 51 204
>XPt  255 51 204
>XAu  255 51 204
>XHg  255 51 204
>XTl  255 51 204
>XPb  255 51 204
>XBi  255 51 204
>XPo  255 51 204
>XAt  255 51 204
>XRn  255 51 204
>XFr  255 51 204
>XRa  255 51 204
>XLr  255 51 204
>XRf  255 51 204
>XDb  255 51 204
>XSg  255 51 204
>XBh  255 51 204
>XHs  255 51 204
>XMt  255 51 204
>XDs  255 51 204
>XRg  255 51 204
>XUu  255 51 204
>XLa  255 51 204
>XCe  255 51 204
>XPr  255 51 204
>XNd  255 51 204
>XPm  255 51 204
>XSm  255 51 204
>XEu  255 51 204
>XGd  255 51 204
>XTb  255 51 204
>XDy  255 51 204
>XHo  255 51 204
>XEr  255 51 204
>XTm  255 51 204
>XYb  255 51 204
>XAc  255 51 204
>XTh  255 51 204
>XPa  255 51 204
>XU   255 51 204     
>XNp  255 51 204
>XPu  255 51 204
>XAm  255 51 204
>XCm  255 51 204
>XBk  255 51 204
>XCf  255 51 204
>XEs  255 51 204
>XFm  255 51 204
>XMd  255 51 204
>XNo  255 51 204
>c18d15373c5735c7a7780b7cbf62d6a6
>exit

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Attachments on bug 138673: 99573