upgrade to 4.3.2
PR: 27273 Submitted by: maintainer
This commit is contained in:
Ying-Chieh Liao
parent
a7587c0158
commit
fa38289059
Notes:
svn2git
2021-03-31 03:12:20 +00:00
svn path=/head/; revision=43133
14 changed files with 411 additions and 480 deletions
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@ -4,48 +4,64 @@
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# $FreeBSD$
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PORTNAME= nab
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PORTVERSION= 4.2
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PORTVERSION= 4.3.2
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CATEGORIES= biology
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MASTER_SITES= ftp://ftp.scripps.edu/pub/case/
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MAINTAINER= bdodson@scms.utmb.edu
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NO_WRKSUBDIR= yes
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MAKE_ENV+= WRKSRC=${WRKSRC} PREFIX=${PREFIX} \
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NABHOME=${PREFIX}/share/nab ARCH= \
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INSTALL_MAN="${INSTALL_MAN}"
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MAKE_ENV+= NABHOME=${WRKSRC} ARCH= PATH=${WRKSRC}/bin:${PATH}
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MAN1= nab.1
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MANCOMPRESSED= yes
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BINARIES= matextract matmul teLeap tss_main \
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matgen nab transform tss_next \
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matmerge nab2c tss_init ucpp
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LIBRARIES= cifparse.a libnab.a libsym.a
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INCS= defreal.h nab.h nabcode.h nabtypes.h
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post-extract:
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@${CP} ${FILESDIR}/Makefile ${WRKSRC}
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@${CP} ${FILESDIR}/Makefile.doc ${WRKSRC}/doc/Makefile
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@${CP} ${FILESDIR}/config.h ${WRKSRC}
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pre-install:
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@cd ${WRKSRC}/src && \
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${SETENV} PREFIX=${PREFIX} ${MAKE} beforerealinstall
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do-install:
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@-mkdir -p ${PREFIX}/share/nab
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.if !defined(${NOPORTDOCS})
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@cd ${WRKSRC} && (tar cf - examples test | \
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@-mkdir -p ${PREFIX}/share/nab/bin
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@-mkdir -p ${PREFIX}/share/nab/include
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@-mkdir -p ${PREFIX}/share/nab/lib
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.if !defined(NOPORTDOCS)
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@cd ${WRKSRC} && (tar cf - examples test peptide suppose | \
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(cd ${PREFIX}/share/nab; tar xf -))
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@-mkdir -p ${PREFIX}/share/doc/nab
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${INSTALL_MAN} ${WRKSRC}/doc/NAB.pdf ${PREFIX}/share/doc/nab
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.endif
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@cd ${WRKSRC} && (tar cf - dgdb reslib | \
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@cd ${WRKSRC} && (tar cf - dgdb reslib fd_data | \
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(cd ${PREFIX}/share/nab; tar xf -))
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@(cd ${PREFIX}/share; ${CHOWN} -R ${SHAREOWN}.${SHAREGRP} nab; \
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${CHMOD} -R ugo+rX-w nab)
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@-(cd ${PREFIX}/share/nab; ${RM} -f coords && ${LN} -s ../NDB coords)
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@-(cd ${PREFIX}/share/nab && ${LN} -sf ../NDB coords)
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${INSTALL_PROGRAM} ${WRKSRC}/bin/* ${PREFIX}/bin
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${INSTALL_DATA} ${WRKSRC}/include/* ${PREFIX}/include
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${INSTALL_DATA} ${WRKSRC}/lib/* ${PREFIX}/lib
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@-cd ${WRKSRC}/doc && ${GZIP_CMD} ${MAN1}
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${INSTALL_MAN} ${WRKSRC}/doc/nab.1.gz ${PREFIX}/man/man1
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.for f in ${BINARIES}
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@cd ${PREFIX}/share/nab/bin && ${LN} -sf ../../../bin/${f} .
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.endfor
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.for f in ${LIBRARIES}
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@cd ${PREFIX}/share/nab/lib && ${LN} -sf ../../../lib/${f} .
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.endfor
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.for f in ${INCS}
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@cd ${PREFIX}/share/nab/include && ${LN} -sf ../../../include/${f} .
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.endfor
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post-install:
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@(cd ${PREFIX}/bin; \
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${RM} -f nab && ${MV} ${PREFIX}/share/nab/bin/nab . ; \
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${RM} -f nab2c && ${MV} ${PREFIX}/share/nab/bin/nab2c . ; \
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${CHOWN} ${BINOWN}:${BINGRP} nab nab2c teLeap ; \
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strip nab nab2c teLeap ; \
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${RMDIR} ${PREFIX}/share/nab/bin)
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@${CAT} ${PKGMESSAGE}
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test: all
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@cd ${WRKSRC}/src && make test
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.include <bsd.port.mk>
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@ -1 +1 @@
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MD5 (nab-4.2.tar.gz) = 5b703cc9dc514549ea97c751fa68f239
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MD5 (nab-4.3.2.tar.gz) = 35a706bd124a212cc8310ca1327be227
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@ -1,6 +0,0 @@
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# $FreeBSD$
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#SUBDIR=cccp cifparse src
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SUBDIR=src tleap doc
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MAN1=nab.1
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.include <bsd.subdir.mk>
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@ -1,5 +0,0 @@
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all:
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install:
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gzip -nfc -9 nab.1 > nab.1.gz
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${INSTALL_MAN} ${WRKSRC}/doc/nab.1.gz ${PREFIX}/man/man1
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@ -1,7 +1,8 @@
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###############################################################################
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# Configuration section: look at sections (1) to (4) below, making
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# changes that seem necessary. For most UNIX systems, no changes
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# should be necessary.
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# changes that seem necessary. For many UNIX systems, no changes
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# should be necessary, but check especially the compiler options in
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# section (4).
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#
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###############################################################################
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#
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@ -9,7 +10,7 @@
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# make command line (e.g. "make ARCH=sun4 NABHOME=/thr/eigen/nab5")
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# or as environment variables.
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#
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# NABHOME should be an absolute path to the directory above this one.
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# NABHOME should be an absolute path to this directory.
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# ARCH is used to distinguish compilations for various architectures.
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#
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# Files created by "make install" end up in:
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@ -20,12 +21,8 @@
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# You can choose ARCH as you wish, but it would generally
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# be related to the output of the "uname" command.
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#
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#BINDIR=$(NABHOME)/bin/$(ARCH)
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#LIBDIR=$(NABHOME)/lib/$(ARCH)
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#NABHOME=/usr/local/share/nab
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#ARCH=
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BINDIR=$(NABHOME)/bin
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LIBDIR=$(NABHOME)/lib
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BINDIR=$(NABHOME)/bin/$(ARCH)
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LIBDIR=$(NABHOME)/lib/$(ARCH)
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INCDIR=$(NABHOME)/include
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#
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###############################################################################
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@ -37,9 +34,8 @@ INCDIR=$(NABHOME)/include
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# included in FLIBS are always searched.)
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#
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#FLIBS=$(LIBDIR)/cifparse.a $(LIBDIR)/libsym.a
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#FLIBS=../cifparse/cifparse.a
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#
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# following for Sun4, Solaris 2.x
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# following for linking in fortran subroutines on Sun4, Solaris 2.x
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#
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#FLIBS=$(LIBDIR)/cifparse.a $(LIBDIR)/libsym.a -lF77 -lM77 -lsunmath
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#
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@ -69,32 +65,40 @@ SHELL= /bin/sh
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#
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# Set the C compiler, etc.
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#
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# (For GNU: cc-->gcc; lex-->flex; yacc-->bison -y -t;
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# Note: If you lexer is "really" flex, you need to set
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# LEX=flex below. For example, on many linux distributions,
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# /usr/bin/lex is really just a pointer to /usr/bin/flex,
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# so LEX=flex is necessary. In general, gcc seems to need
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# flex.)
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# For GNU: cc-->gcc; lex-->flex; yacc-->bison -y -t;
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# Note: If you lexer is "really" flex, you need to set
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# LEX=flex below. For example, on many linux distributions,
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# /usr/bin/lex is really just a pointer to /usr/bin/flex,
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# so LEX=flex is necessary. In general, gcc seems to need
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# flex.
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#
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# For 64-bit IRIX, add "-n32" unless 64-bit objects are
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# needed; it is also useful to add "-Wl,-dont_warn_unused"
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# to keep the loader from complaining about libraries that
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# are not used.
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#
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# For RedHat Linux 5.1 (and other linuxes?) add -DHAVE_STRERROR
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#
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# For FreeBSD 4.2-STABLE, there seems to be a dependency
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# on bison. Berkeley yacc was very problematic.
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CC= cc
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LEX= flex
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YACC= yacc
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YACC= bison -y -t
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AR= ar
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#
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# Set the C-preprocessor. Code for the preprocessor from gcc is in
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# ../cccp; it gets installed as $(NABHOME)/bin/$(ARCH)/cpp;
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# Set the C-preprocessor. Code for a small preprocessor is in
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# uccp-0.7; it gets installed as $(NABHOME)/bin/$(ARCH)/ucpp;
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# this should generally *not* be changed.
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#
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#CPP= $(NABHOME)/bin/$(ARCH)/cpp -lang-c++
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#CPP= ../cccp/cpp -lang-c++
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CPP= cc -E -x c++
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# Again, for FreeBSD 4.2-STABLE, I had problems using the system
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# C-preprocessor.
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#
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CPP= ucpp -l
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#
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# Use these CFLAGS if AVS = 0
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# Notes: for 64-bit IRIX, add "-n32" to both CFLAGS and OCFLAGS
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# for RedHat Linux 5.1 (and other linuxes?) add -DHAVE_STRERROR
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#
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CFLAGS=
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OCFLAGS= -O
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CFLAGS= -DHAVE_STRERROR ${OCFLAGS}
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NABFLAGS=
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#
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# Use these CFLAGS if AVS = 1
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@ -103,7 +107,7 @@ NABFLAGS=
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#OCFLAGS= -O -DAVS=$(AVS) -DAVSDIR='"$(AVSDIR)"' -I$(AVSINCDIR)
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#
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#
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# For Win95, set SFX to ".exe"; for Unix,NT leave it empty:
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# For Win95/98, set SFX to ".exe"; for Unix,NT leave it empty:
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#
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#SFX=.exe
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SFX=
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|
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@ -1,25 +1,32 @@
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*** src/Makefile.orig Fri Jan 8 16:06:59 1999
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--- src/Makefile Thu Jan 14 16:15:53 1999
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*** Makefile.orig Mon Oct 23 20:01:09 2000
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--- Makefile Sun Jan 28 13:36:22 2001
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***************
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*** 1,5 ****
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--- 1,6 ----
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# top-level Makefile for the NAB suite of programs
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+ all: compiler test
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compiler:
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-mkdir bin lib include
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(cd ucpp-0.7; make install )
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***************
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*** 7,15 ****
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./nab -c $(NABFLAGS) $<
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@rm -f $*.c
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(cd src; make install )
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(cd nss; make install )
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(cd tleap; make install )
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! @echo
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! @echo "completed installation of NAB version 4"
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! @echo
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- .c.o: $<
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- $(CC) -c $(CFLAGS) $<
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-
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NAB2COBJS= \
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nab2c.o \
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cgen.o \
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--- 7,12 ----
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***************
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*** 77,82 ****
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--- 74,81 ----
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yammp.o
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# note: "make test" needs to follow "make", since it is very hard to
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# tell if the compiler is completely "made" or not.
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--- 8,16 ----
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(cd src; make install )
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(cd nss; make install )
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(cd tleap; make install )
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! # @echo
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! # @echo "completed installation of NAB version 4"
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! # @echo
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#===========================================================================
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+
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+ all: system
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system: nab \
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nab2c \
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# note: "make test" needs to follow "make", since it is very hard to
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# tell if the compiler is completely "made" or not.
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||||
|
|
|
|||
|
|
@ -1,13 +1,18 @@
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*** cccp/Makefile.orig Thu Jan 14 16:20:38 1999
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--- cccp/Makefile Thu Jan 14 16:21:08 1999
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*** src/Makefile.orig Mon Nov 13 13:37:07 2000
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--- src/Makefile Mon Jan 29 12:33:37 2001
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***************
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*** 4,9 ****
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--- 4,11 ----
|
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######### no configuration should be needed beyond this line #################
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##############################################################################
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*** 175,180 ****
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--- 175,187 ----
|
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cp defreal.h $(INCDIR)
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cp nab.h $(INCDIR)
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|
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+ all: cpp$(SFX)
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+ beforerealinstall:
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+ $(CC) -DBINDIR='"$(PREFIX)/bin"' \
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+ -DINCDIR='"$(PREFIX)/include"' \
|
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+ -DLIBDIR='"$(PREFIX)/lib"' \
|
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+ $(CFLAGS) -DCC='"$(CC)"' -DCPP='"$(CPP)"' -DFLIBS='"$(FLIBS)"' \
|
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+ -o ../bin/nab nab.c
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+
|
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cpp$(SFX): cppmain.o cpplib.o cpphash.o cppalloc.o cpperror.o cppexp.o version.o \
|
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obstack.o alloca.o
|
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$(CC) $(CFLAGS) -o cpp$(SFX) cppmain.o cpplib.o cpphash.o \
|
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uninstall: clean
|
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-rm -f \
|
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$(BINDIR)/nab2c$(SFX) $(BINDIR)/nab$(SFX) $(INCDIR)/nabcode.h \
|
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|
|
|
|||
|
|
@ -1,13 +0,0 @@
|
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*** cifparse/Makefile.orig Thu Jan 14 16:21:50 1999
|
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--- cifparse/Makefile Thu Jan 14 16:22:08 1999
|
||||
***************
|
||||
*** 11,16 ****
|
||||
--- 11,18 ----
|
||||
cifp.tab.o \
|
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cifparse.o
|
||||
|
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+ all: cifparse.a
|
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+
|
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cifparse.a: $(CIFOBS)
|
||||
-rm cifparse.a
|
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$(AR) rv cifparse.a $(CIFOBS)
|
||||
|
|
@ -1,19 +0,0 @@
|
|||
*** examples/program_7.nab.orig Thu Jan 14 16:53:07 1999
|
||||
--- examples/program_7.nab Thu Jan 14 16:53:24 1999
|
||||
***************
|
||||
*** 9,15 ****
|
||||
cseq = wc_complement( "acgtacgt", "dna.amber94.rlb", "dna" );
|
||||
|
||||
m = wc_helix( seq, "dna.amber94.rlb", "dna", cseq, "dna.amber94.rlb",
|
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! "dna", 2.25, -4.96, 36.0, 4.38, "" );
|
||||
|
||||
b = newbounds(m, "");
|
||||
allocate xyz[ 4*m.natoms ];
|
||||
--- 9,15 ----
|
||||
cseq = wc_complement( "acgtacgt", "dna.amber94.rlb", "dna" );
|
||||
|
||||
m = wc_helix( seq, "dna.amber94.rlb", "dna", cseq, "dna.amber94.rlb",
|
||||
! "dna", 2.25, -4.96, 36.0, 3.38, "" );
|
||||
|
||||
b = newbounds(m, "");
|
||||
allocate xyz[ 4*m.natoms ];
|
||||
|
|
@ -1,23 +0,0 @@
|
|||
*** src/reslib.c.orig Tue Apr 21 14:10:50 1998
|
||||
--- src/reslib.c Mon Feb 1 09:50:35 1999
|
||||
***************
|
||||
*** 610,618 ****
|
||||
fclose( cfp );
|
||||
}
|
||||
|
||||
! fclose( pfp );
|
||||
|
||||
! fclose( bfp );
|
||||
|
||||
return( rlp );
|
||||
}
|
||||
--- 610,618 ----
|
||||
fclose( cfp );
|
||||
}
|
||||
|
||||
! if( pfp ) {fclose( pfp );}
|
||||
|
||||
! if( bfp ) {fclose( bfp );}
|
||||
|
||||
return( rlp );
|
||||
}
|
||||
|
|
@ -1,32 +0,0 @@
|
|||
*** src/database.c.orig Tue Apr 21 12:17:17 1998
|
||||
--- src/database.c Tue Mar 9 09:09:06 1999
|
||||
***************
|
||||
*** 73,78 ****
|
||||
--- 73,85 ----
|
||||
|
||||
#include "database.h"
|
||||
|
||||
+ #if (defined(__unix__) || defined(unix)) && !defined(USG)
|
||||
+ #include <sys/param.h>
|
||||
+ #endif
|
||||
+
|
||||
+ #if defined(BSD)
|
||||
+ #include <math.h>
|
||||
+ #endif
|
||||
|
||||
#ifndef TRUE
|
||||
#define TRUE 1
|
||||
***************
|
||||
*** 985,991 ****
|
||||
--- 992,1002 ----
|
||||
|
||||
sDBRemoveLeadingSpaces( sLine );
|
||||
sDBRemoveFirstString( sLine, sHead );
|
||||
+ #if defined(linux) || defined(BSD)
|
||||
+ sscanf( sHead, "%lg", dPDbl );
|
||||
+ #else
|
||||
sscanf( sHead, "%lG", dPDbl );
|
||||
+ #endif
|
||||
|
||||
}
|
||||
|
||||
|
|
@ -1,19 +0,0 @@
|
|||
*** semantics/Makefile.orig Fri Mar 10 20:08:16 2000
|
||||
--- semantics/Makefile Sun Sep 10 18:47:44 2000
|
||||
***************
|
||||
*** 43,49 ****
|
||||
SYM_UPARROW_ASSIGN.rules
|
||||
|
||||
checkexpr.c: $(RULES) attribute.tab parse ../src/nab.h ../src/nabgrm.y
|
||||
! ./parse *.rules
|
||||
|
||||
parse: parse.c
|
||||
$(CC) -o parse parse.c
|
||||
--- 43,49 ----
|
||||
SYM_UPARROW_ASSIGN.rules
|
||||
|
||||
checkexpr.c: $(RULES) attribute.tab parse ../src/nab.h ../src/nabgrm.y
|
||||
! env NABHOME=.. ./parse *.rules
|
||||
|
||||
parse: parse.c
|
||||
$(CC) -o parse parse.c
|
||||
|
|
@ -1,41 +0,0 @@
|
|||
*** tleap/Makefile.orig Tue Jun 20 13:41:55 2000
|
||||
--- tleap/Makefile Sun Sep 10 19:38:24 2000
|
||||
***************
|
||||
*** 5,13 ****
|
||||
.SUFFIXES:
|
||||
.SUFFIXES: .c .o
|
||||
|
||||
- .c.o: $<
|
||||
- $(CC) -c $(CFLAGS) -DSYSV $<
|
||||
-
|
||||
#
|
||||
# Absolutely necessary routines
|
||||
#
|
||||
--- 5,10 ----
|
||||
***************
|
||||
*** 76,81 ****
|
||||
--- 73,79 ----
|
||||
OUL2P= utilLib2Pdb.o
|
||||
|
||||
TLEAP_OBJ= $(OA) $(OG) $(OO) $(OL) $(OC)
|
||||
+ all: teLeap$(SFX)
|
||||
teLeap$(SFX): $(TLEAP_OBJ)
|
||||
$(CC) -o $@ $(TLEAP_OBJ) -lm
|
||||
|
||||
***************
|
||||
*** 409,415 ****
|
||||
zMatrix.o: zMatrix.h
|
||||
|
||||
install: teLeap$(SFX)
|
||||
! mv teLeap$(SFX) $(BINDIR)
|
||||
|
||||
uninstall: clean
|
||||
-rm $(BINDIR)/teLeap$(SFX)
|
||||
--- 407,413 ----
|
||||
zMatrix.o: zMatrix.h
|
||||
|
||||
install: teLeap$(SFX)
|
||||
! mv teLeap$(SFX) $(PREFIX)/bin
|
||||
|
||||
uninstall: clean
|
||||
-rm $(BINDIR)/teLeap$(SFX)
|
||||
|
|
@ -1,281 +1,338 @@
|
|||
bin/matextract
|
||||
bin/matgen
|
||||
bin/matmerge
|
||||
bin/matmul
|
||||
bin/nab
|
||||
bin/nab2c
|
||||
bin/teLeap
|
||||
bin/transform
|
||||
bin/tss_init
|
||||
bin/tss_main
|
||||
bin/tss_next
|
||||
bin/ucpp
|
||||
include/defreal.h
|
||||
include/nab.h
|
||||
include/nabcode.h
|
||||
include/nabtypes.h
|
||||
lib/cifparse.a
|
||||
lib/libnab.a
|
||||
lib/libsym.a
|
||||
share/doc/nab/NAB.pdf
|
||||
share/nab/lib/libnab.a
|
||||
share/nab/include/nabcode.h
|
||||
share/nab/include/nab.h
|
||||
share/nab/include/defreal.h
|
||||
share/nab/include/nabtypes.h
|
||||
share/nab/examples/program_1.nab
|
||||
share/nab/examples/program_2.nab
|
||||
share/nab/examples/program_3.nab
|
||||
share/nab/examples/program_4.nab
|
||||
share/nab/examples/program_5.nab
|
||||
share/nab/examples/program_6.nab
|
||||
share/nab/examples/program_7.nab
|
||||
share/nab/examples/program_7.nab.orig
|
||||
share/nab/examples/README
|
||||
share/nab/examples/program_9.nab
|
||||
share/nab/examples/program_10.nab
|
||||
share/nab/examples/program_11.nab
|
||||
share/nab/examples/program_12.nab
|
||||
share/nab/examples/program_13.nab
|
||||
share/nab/examples/program_14.nab
|
||||
share/nab/examples/program_8.nab
|
||||
share/nab/bin/matextract
|
||||
share/nab/bin/matmul
|
||||
share/nab/bin/teLeap
|
||||
share/nab/bin/tss_main
|
||||
share/nab/bin/matgen
|
||||
share/nab/bin/nab
|
||||
share/nab/bin/transform
|
||||
share/nab/bin/tss_next
|
||||
share/nab/bin/matmerge
|
||||
share/nab/bin/nab2c
|
||||
share/nab/bin/tss_init
|
||||
share/nab/bin/ucpp
|
||||
share/nab/examples/test.pdb
|
||||
share/nab/examples/ADE.pdb
|
||||
share/nab/examples/README
|
||||
share/nab/examples/Makefile
|
||||
share/nab/examples/program_9.nab
|
||||
share/nab/examples/gcg10.pdb
|
||||
share/nab/examples/program_8.nab
|
||||
share/nab/examples/program_7.nab
|
||||
share/nab/examples/program_6.nab
|
||||
share/nab/examples/rna_pseudoknot.pdb
|
||||
share/nab/examples/THY.pdb
|
||||
share/nab/examples/program_5.gcg.in
|
||||
share/nab/examples/program_5.nab
|
||||
share/nab/examples/getbase.nab
|
||||
share/nab/examples/program_14.nab
|
||||
share/nab/examples/program_4.ref
|
||||
share/nab/examples/program_4.nab
|
||||
share/nab/examples/acgtacgt.pdb
|
||||
share/nab/examples/program_5.tat.in
|
||||
share/nab/examples/program_3.nab
|
||||
share/nab/examples/program_12.nab
|
||||
share/nab/examples/program_2.ref
|
||||
share/nab/examples/program_2.nab
|
||||
share/nab/examples/program_13.nab
|
||||
share/nab/examples/program_5.cgc.in
|
||||
share/nab/examples/program_1.nab
|
||||
share/nab/examples/program_10.nab
|
||||
share/nab/examples/program_5.ata.in
|
||||
share/nab/examples/test.sup.pdb
|
||||
share/nab/examples/program_11.nab
|
||||
share/nab/examples/gcg10.pdb.save
|
||||
share/nab/examples/program_7.nab.orig
|
||||
share/nab/test/get_sugar_info.nab
|
||||
share/nab/test/get_pep_info.nab
|
||||
share/nab/test/read_obs_shifts.nab
|
||||
share/nab/test/hash.out.check
|
||||
share/nab/test/ico.sym.out.check
|
||||
share/nab/test/2.pdb
|
||||
share/nab/test/sbcoil.nab
|
||||
share/nab/test/ltest.nab
|
||||
share/nab/test/prmtop
|
||||
share/nab/test/reflexive.nab
|
||||
share/nab/test/reflexive.out
|
||||
share/nab/test/duplex.in
|
||||
share/nab/test/hash.in
|
||||
share/nab/test/gbrna.prmtop
|
||||
share/nab/test/fd.nab
|
||||
share/nab/test/gbrna.out.check
|
||||
share/nab/test/d01.pdb.check
|
||||
share/nab/test/fd.pdb.check
|
||||
share/nab/test/d01.lin.check
|
||||
share/nab/test/swap_shifts.nab
|
||||
share/nab/test/shifts.h
|
||||
share/nab/test/ico.sym
|
||||
share/nab/test/gbrna.pdb
|
||||
share/nab/test/gbrna.nab
|
||||
share/nab/test/tbv.60.com.pdb.check
|
||||
share/nab/test/hash.nab
|
||||
share/nab/test/5pti.shifts.check
|
||||
share/nab/test/5pti.obs
|
||||
share/nab/test/5pti.pdb
|
||||
share/nab/test/dna.circle.nab
|
||||
share/nab/test/tbv.com.pdb
|
||||
share/nab/test/pointplane.nab
|
||||
share/nab/test/dg_gyrate.nab
|
||||
share/nab/test/getresid_from_pdb.nab
|
||||
share/nab/test/get_ring_info.nab
|
||||
share/nab/test/shifts.nab
|
||||
share/nab/test/write_sander_inp.nab
|
||||
share/nab/test/duplex.nab
|
||||
share/nab/test/ltest.out.check
|
||||
share/nab/test/dg_gyrate.out.check
|
||||
share/nab/peptide/COPYING
|
||||
share/nab/peptide/aaaa.pdb
|
||||
share/nab/peptide/lprot.nab
|
||||
share/nab/peptide/write_pdb.nab
|
||||
share/nab/peptide/README
|
||||
share/nab/peptide/Makefile
|
||||
share/nab/peptide/conf.lib
|
||||
share/nab/peptide/peptide.nab
|
||||
share/nab/peptide/match_template.nab
|
||||
share/nab/peptide/peptide.c
|
||||
share/nab/peptide/fix_angles.nab
|
||||
share/nab/suppose/suppose.1
|
||||
share/nab/suppose/suppose.nab
|
||||
share/nab/dgdb/adna.basepair.db
|
||||
share/nab/dgdb/adna.nucleotide.db
|
||||
share/nab/dgdb/adna.stack.db
|
||||
share/nab/dgdb/arna.basepair.db
|
||||
share/nab/dgdb/arna.nucleotide.db
|
||||
share/nab/dgdb/arna.stack.db
|
||||
share/nab/dgdb/bdna.basepair.db
|
||||
share/nab/dgdb/bdna.nucleotide.db
|
||||
share/nab/dgdb/bdna.stack.db
|
||||
share/nab/dgdb/trna.stack.db
|
||||
share/nab/dgdb/arna.basepair.db
|
||||
share/nab/dgdb/trna.basepair.db
|
||||
share/nab/dgdb/zdna.nucleotide.db
|
||||
share/nab/dgdb/adna.nucleotide.db
|
||||
share/nab/dgdb/adna.basepair.db
|
||||
share/nab/dgdb/adna.stack.db
|
||||
share/nab/dgdb/zdna.basepair.db
|
||||
share/nab/dgdb/zdna.stack.db
|
||||
share/nab/dgdb/trna.nucleotide.db
|
||||
share/nab/dgdb/dna.basepair.db
|
||||
share/nab/dgdb/arna.nucleotide.db
|
||||
share/nab/dgdb/rna.basepair.db
|
||||
share/nab/dgdb/arna.stack.db
|
||||
share/nab/reslib/bdna.std/bdna.std.bnd
|
||||
share/nab/reslib/bdna.std/bdna.std.chi
|
||||
share/nab/reslib/bdna.std/bdna.std.pdb
|
||||
share/nab/reslib/bdna.std/dna.qr
|
||||
share/nab/reslib/bounds.db
|
||||
share/nab/reslib/protein.opls/protein.opls.bnd
|
||||
share/nab/reslib/protein.opls/protein.opls.chi
|
||||
share/nab/reslib/protein.opls/protein.opls.pdb
|
||||
share/nab/reslib/protein.opls/protein.opls.qr
|
||||
share/nab/reslib/arna.std/arna.std.bnd
|
||||
share/nab/reslib/arna.std/arna.std.pdb
|
||||
share/nab/reslib/adna.std.rlb
|
||||
share/nab/reslib/axes/Axes.bnd
|
||||
share/nab/reslib/axes/XYZ.axes
|
||||
share/nab/reslib/rna.amber94/rna.amber94.3.bnd
|
||||
share/nab/reslib/rna.amber94/rna.amber94.3.pdb
|
||||
share/nab/reslib/rna.amber94/rna.amber94.5.qr
|
||||
share/nab/reslib/rna.amber94/rna.amber94.5.bnd
|
||||
share/nab/reslib/rna.amber94/rna.amber94.5.pdb
|
||||
share/nab/reslib/rna.amber94/rna.amber94.qr
|
||||
share/nab/reslib/rna.amber94/rna.amber94.bnd
|
||||
share/nab/reslib/rna.amber94/rna.amber94.chi
|
||||
share/nab/reslib/rna.amber94/rna.amber94.pdb
|
||||
share/nab/reslib/rna.amber94/rna.amber94.3.qr
|
||||
share/nab/reslib/rna.amber94/rna.amber94_nmr.3.qr
|
||||
share/nab/reslib/rna.amber94/rna.amber94_nmr.qr
|
||||
share/nab/reslib/rna.amber94/rna.amber94_nmr.5.qr
|
||||
share/nab/reslib/arna.std.rlb
|
||||
share/nab/reslib/protein.amber94/protein.amber94.C.bnd
|
||||
share/nab/reslib/protein.amber94/protein.amber94.C.pdb
|
||||
share/nab/reslib/protein.amber94/protein.amber94.C.qr
|
||||
share/nab/reslib/protein.amber94/protein.amber94.N.bnd
|
||||
share/nab/reslib/protein.amber94/protein.amber94.N.pdb
|
||||
share/nab/reslib/protein.amber94/protein.amber94.N.qr
|
||||
share/nab/reslib/protein.amber94/protein.amber94.NC.chi
|
||||
share/nab/reslib/protein.amber94/protein.amber94.bnd
|
||||
share/nab/reslib/protein.amber94/protein.amber94.chi
|
||||
share/nab/reslib/protein.amber94/protein.amber94.pdb
|
||||
share/nab/reslib/protein.amber94/protein.amber94.qr
|
||||
share/nab/reslib/protein.amber94/protein.amber94_nmr.qr
|
||||
share/nab/reslib/bdna.std.rlb
|
||||
share/nab/reslib/dna.amber94_nmr.5.rlb
|
||||
share/nab/reslib/dna.amber94/dna.amber94.3.bnd
|
||||
share/nab/reslib/dna.amber94/dna.amber94.3.pdb
|
||||
share/nab/reslib/dna.amber94/dna.amber94.3.qr
|
||||
share/nab/reslib/dna.amber94/dna.amber94.5.bnd
|
||||
share/nab/reslib/dna.amber94/dna.amber94.5.pdb
|
||||
share/nab/reslib/dna.amber94/dna.amber94.5.qr
|
||||
share/nab/reslib/dna.amber94/dna.amber94.bnd
|
||||
share/nab/reslib/dna.amber94/dna.amber94.chi
|
||||
share/nab/reslib/dna.amber94/dna.amber94.pdb
|
||||
share/nab/reslib/dna.amber94/dna.amber94.qr
|
||||
share/nab/reslib/dna.amber94/dna.amber94_nmr.3.qr
|
||||
share/nab/reslib/dna.amber94/dna.amber94_nmr.5.qr
|
||||
share/nab/reslib/dna.amber94/dna.amber94_nmr.qr
|
||||
share/nab/reslib/dna.amber94/ade.pdb
|
||||
share/nab/reslib/dna.amber94/dna.amber94.35.chi
|
||||
share/nab/reslib/adna.std/adna.std.bnd
|
||||
share/nab/reslib/adna.std/adna.std.pdb
|
||||
share/nab/reslib/dna.amber94.3.rlb
|
||||
share/nab/reslib/dna.amber94.5.rlb
|
||||
share/nab/reslib/dna.amber94_nmr.rlb
|
||||
share/nab/reslib/dna.amber94.rlb
|
||||
share/nab/reslib/dna.amber94_nmr.3.rlb
|
||||
share/nab/reslib/rna.amber94.rlb
|
||||
share/nab/reslib/leap/all_amino94.lib
|
||||
share/nab/reslib/leap/all_aminoct94.lib
|
||||
share/nab/reslib/leap/all_aminont94.lib
|
||||
share/nab/reslib/leap/all_nucleic94.lib
|
||||
share/nab/reslib/leap/ions94.lib
|
||||
share/nab/reslib/leap/leaprc.std
|
||||
share/nab/reslib/leap/parm91X.dat
|
||||
share/nab/reslib/leap/parm94.dat
|
||||
share/nab/reslib/leap/leaprc.nmr
|
||||
share/nab/reslib/leap/na.amberua.prepin
|
||||
share/nab/reslib/leap/ions91.lib
|
||||
share/nab/reslib/leap/water.lib
|
||||
share/nab/reslib/leap/protein.opls.lib
|
||||
share/nab/reslib/leap/opls_parm.dat
|
||||
share/nab/reslib/leap/leaprc.dna.amberua
|
||||
share/nab/reslib/leap/rna.amberua.lib
|
||||
share/nab/reslib/leap/dna.amberua.lib
|
||||
share/nab/reslib/leap/parm91X.ua.dat
|
||||
share/nab/reslib/leap/pro-dna91.nmr.db4
|
||||
share/nab/reslib/leap/Notes
|
||||
share/nab/reslib/leap/0README
|
||||
share/nab/reslib/leap/parm91.lib
|
||||
share/nab/reslib/leap/pro-dna91.nmr.lib
|
||||
share/nab/reslib/leap/protein.amberua.C.prepin
|
||||
share/nab/reslib/leap/protein.amberua.N.prepin
|
||||
share/nab/reslib/leap/protein.amberua.prepin
|
||||
share/nab/reslib/leap/pro-dna91.nmr.prepin
|
||||
share/nab/reslib/leap/leaprc.rna.amberua
|
||||
share/nab/reslib/leap/dna.amberua.redch.lib
|
||||
share/nab/reslib/leap/leaprc.dna.amberua.redch
|
||||
share/nab/reslib/leap/leaprc.rna
|
||||
share/nab/reslib/leap/protein.amberua.lib
|
||||
share/nab/reslib/leap/leaprc.protein.amberua
|
||||
share/nab/reslib/leap/leap.log
|
||||
share/nab/reslib/leap/all_amino91.lib
|
||||
share/nab/reslib/leap/all_aminoct91.lib
|
||||
share/nab/reslib/leap/all_aminont91.lib
|
||||
share/nab/reslib/leap/all_nucleic91.lib
|
||||
share/nab/reslib/protein.amber94.C.rlb
|
||||
share/nab/reslib/protein.amber94.N.rlb
|
||||
share/nab/reslib/protein.amber94.rlb
|
||||
share/nab/reslib/protein.opls.rlb
|
||||
share/nab/reslib/axes.rlb
|
||||
share/nab/reslib/hetatm.amber94/hetatm.amber94.qr
|
||||
share/nab/reslib/hetatm.amber94/hetatm.amber94.pdb
|
||||
share/nab/dgdb/trna.basepair.db
|
||||
share/nab/dgdb/trna.nucleotide.db
|
||||
share/nab/dgdb/trna.stack.db
|
||||
share/nab/dgdb/zdna.basepair.db
|
||||
share/nab/dgdb/zdna.nucleotide.db
|
||||
share/nab/dgdb/zdna.stack.db
|
||||
share/nab/reslib/leap.log
|
||||
share/nab/reslib/hetatm.amber94/hetatm.amber94.chi
|
||||
share/nab/reslib/hetatm.amber94/hetatm.amber94.bnd
|
||||
share/nab/reslib/dna.amberua/dna.amberua.bnd
|
||||
share/nab/reslib/dna.amberua/dna.amberua.pdb
|
||||
share/nab/reslib/dna.amberua/dna.amberua.qr
|
||||
share/nab/reslib/dna.amberua/dna.amberua.5.bnd
|
||||
share/nab/reslib/dna.amberua/dna.amberua.5.pdb
|
||||
share/nab/reslib/dna.amberua/dna.amberua.3.qr
|
||||
share/nab/reslib/dna.amberua/dna.amberua.3.bnd
|
||||
share/nab/reslib/dna.amberua/dna.amberua.3.pdb
|
||||
share/nab/reslib/dna.amberua/dna.amberua.chi
|
||||
share/nab/reslib/dna.amberua/dna.amberua.5.qr
|
||||
share/nab/reslib/hetatm.amber94.rlb
|
||||
share/nab/reslib/dna.amberua.rlb
|
||||
share/nab/reslib/rna.amberua/rna.amberua.3.bnd
|
||||
share/nab/reslib/rna.amberua/rna.amberua.3.pdb
|
||||
share/nab/reslib/rna.amberua/rna.amberua.5.qr
|
||||
share/nab/reslib/rna.amberua/rna.amberua.5.bnd
|
||||
share/nab/reslib/rna.amberua/rna.amberua.5.pdb
|
||||
share/nab/reslib/rna.amberua/rna.amberua.qr
|
||||
share/nab/reslib/rna.amberua/rna.amberua.bnd
|
||||
share/nab/reslib/rna.amberua/rna.amberua.pdb
|
||||
share/nab/reslib/rna.amberua/rna.amberua.chi
|
||||
share/nab/reslib/rna.amberua/rna.amberua.3.qr
|
||||
share/nab/reslib/pro-dna.nmr/pro-dna.nmr.input
|
||||
share/nab/reslib/pro-dna.nmr/pro-dna.nmr.off
|
||||
share/nab/reslib/pro-dna.nmr/pro-dna.nmr.star
|
||||
share/nab/reslib/dna.amberua.5.rlb
|
||||
share/nab/reslib/dna.amberua.3.rlb
|
||||
share/nab/reslib/rna.amberua.rlb
|
||||
share/nab/reslib/rna.amberua.3.rlb
|
||||
share/nab/reslib/rna.amberua.5.rlb
|
||||
share/nab/reslib/rna.amber94.5.rlb
|
||||
share/nab/reslib/rna.amber94.3.rlb
|
||||
share/nab/reslib/rna.amber94_nmr.3.rlb
|
||||
share/nab/reslib/ala.off
|
||||
share/nab/reslib/rna.amber94_nmr.5.rlb
|
||||
share/nab/reslib/rna.amber94_nmr.rlb
|
||||
share/nab/reslib/protein.amber94_nmr.rlb
|
||||
share/nab/reslib/leap.log
|
||||
share/nab/reslib/off2star
|
||||
share/nab/reslib/pep1.off
|
||||
share/nab/reslib/cdd.mol2
|
||||
share/nab/reslib/syblCDD.lib
|
||||
share/nab/reslib/parm94.star
|
||||
share/nab/reslib/hetatm.amber94/hetatm.amber94.pdb
|
||||
share/nab/reslib/hetatm.amber94/hetatm.amber94.qr
|
||||
share/nab/reslib/charlie.star.note
|
||||
share/nab/reslib/conf.lib
|
||||
share/nab/reslib/axes/Axes.bnd
|
||||
share/nab/reslib/axes/XYZ.axes
|
||||
share/nab/reslib/dna3/dna3.qr
|
||||
share/nab/reslib/dna3/dna3.bnd
|
||||
share/nab/reslib/dna3/dna3.chi
|
||||
share/nab/reslib/dna3/dna3.pdb
|
||||
share/nab/reslib/leap/leap.log
|
||||
share/nab/reslib/leap/opls_parm.dat
|
||||
share/nab/reslib/leap/leaprc.stdX
|
||||
share/nab/reslib/leap/parm91X.ua.dat
|
||||
share/nab/reslib/leap/parm94.dat
|
||||
share/nab/reslib/leap/protein.amberua.N.prepin
|
||||
share/nab/reslib/leap/protein.amberua.C.prepin
|
||||
share/nab/reslib/leap/leaprc.nmr
|
||||
share/nab/reslib/leap/leaprc.std
|
||||
share/nab/reslib/leap/leaprc.rna
|
||||
share/nab/reslib/leap/water.lib
|
||||
share/nab/reslib/leap/na.amberua.prepin
|
||||
share/nab/reslib/leap/0README
|
||||
share/nab/reslib/leap/protein.opls.lib
|
||||
share/nab/reslib/leap/protein.amberua.prepin
|
||||
share/nab/reslib/leap/leaprc.protein.amberua
|
||||
share/nab/reslib/leap/parm91.lib
|
||||
share/nab/reslib/leap/parm91X.dat
|
||||
share/nab/reslib/leap/parm94X.dat
|
||||
share/nab/reslib/leap/protein.amberua.lib
|
||||
share/nab/reslib/leap/dna.amberua.lib
|
||||
share/nab/reslib/leap/rna.amberua.lib
|
||||
share/nab/reslib/leap/all_aminoct91.lib
|
||||
share/nab/reslib/leap/all_aminont91.lib
|
||||
share/nab/reslib/leap/all_nucleic91.lib
|
||||
share/nab/reslib/leap/dna.amberua.redch.lib
|
||||
share/nab/reslib/leap/all_amino91.lib
|
||||
share/nab/reslib/leap/ions94.lib
|
||||
share/nab/reslib/leap/all_amino94.lib
|
||||
share/nab/reslib/leap/all_aminoct94.lib
|
||||
share/nab/reslib/leap/all_aminont94.lib
|
||||
share/nab/reslib/leap/all_nucleic94.lib
|
||||
share/nab/reslib/leap/leaprc.dna.amberua.redch
|
||||
share/nab/reslib/leap/leaprc.rna.amberua
|
||||
share/nab/reslib/leap/leaprc.dna.amberua
|
||||
share/nab/reslib/leap/Notes
|
||||
share/nab/reslib/leap/ions91.lib
|
||||
share/nab/reslib/leap/pro-dna91.nmr.lib
|
||||
share/nab/reslib/leap/pro-dna91.nmr.prepin
|
||||
share/nab/reslib/leap/WW7.lib
|
||||
share/nab/reslib/bdna.std/bdna.std.bnd
|
||||
share/nab/reslib/bdna.std/bdna.std.chi
|
||||
share/nab/reslib/bdna.std/bdna.std.pdb
|
||||
share/nab/reslib/bdna.std/dna.qr
|
||||
share/nab/reslib/arna.std/arna.std.bnd
|
||||
share/nab/reslib/arna.std/arna.std.pdb
|
||||
share/nab/reslib/adna.std/adna.std.bnd
|
||||
share/nab/reslib/adna.std/adna.std.pdb
|
||||
share/nab/reslib/pep1.off
|
||||
share/nab/reslib/ala.off
|
||||
share/nab/reslib/protein.opls/protein.opls.bnd
|
||||
share/nab/reslib/protein.opls/protein.opls.chi
|
||||
share/nab/reslib/protein.opls/protein.opls.pdb
|
||||
share/nab/reslib/protein.opls/protein.opls.qr
|
||||
share/nab/reslib/parm94.star
|
||||
share/nab/reslib/bdna.std.rlb
|
||||
share/nab/reslib/adna.std.rlb
|
||||
share/nab/reslib/arna.std.rlb
|
||||
share/nab/reslib/bounds.db
|
||||
share/nab/reslib/off2star
|
||||
share/nab/reslib/dna3.rlb
|
||||
share/nab/test/duplex.in
|
||||
share/nab/test/5pti.obs
|
||||
share/nab/test/5pti.pdb
|
||||
share/nab/test/prmtop
|
||||
share/nab/test/2.pdb
|
||||
share/nab/test/d01.lin.check
|
||||
share/nab/test/ltest.nab
|
||||
share/nab/test/d01.pdb.check
|
||||
share/nab/test/dna.circle.nab
|
||||
share/nab/test/duplex.nab
|
||||
share/nab/test/hash.in
|
||||
share/nab/test/hash.nab
|
||||
share/nab/test/hash.out.check
|
||||
share/nab/test/ltest.out.check
|
||||
share/nab/test/get_pep_info.nab
|
||||
share/nab/test/get_ring_info.nab
|
||||
share/nab/test/get_sugar_info.nab
|
||||
share/nab/test/getresid_from_pdb.nab
|
||||
share/nab/test/ico.sym
|
||||
share/nab/test/read_obs_shifts.nab
|
||||
share/nab/test/sbcoil.nab
|
||||
share/nab/test/shifts.nab
|
||||
share/nab/test/swap_shifts.nab
|
||||
share/nab/test/write_sander_inp.nab
|
||||
share/nab/test/shifts.h
|
||||
share/nab/test/reflexive.nab
|
||||
share/nab/test/reflexive.out
|
||||
share/nab/test/dg_gyrate.nab
|
||||
share/nab/test/5pti.shifts.check
|
||||
share/nab/test/ico.sym.out.check
|
||||
share/nab/test/tbv.com.pdb
|
||||
share/nab/test/dg_gyrate.out.check
|
||||
share/nab/test/tbv.60.com.pdb.check
|
||||
share/nab/test/gbrna.prmtop
|
||||
share/nab/test/gbrna.out.check
|
||||
share/nab/test/gbrna.pdb
|
||||
share/nab/test/gbrna.nab
|
||||
share/nab/test/pointplane.nab
|
||||
share/nab/reslib/axes.rlb
|
||||
share/nab/reslib/hetatm.amber94.rlb
|
||||
share/nab/reslib/rna.amber94_nmr.rlb
|
||||
share/nab/reslib/dna.amber94/dna.amber94_nmr.3.qr
|
||||
share/nab/reslib/dna.amber94/dna.amber94_nmr.5.qr
|
||||
share/nab/reslib/dna.amber94/dna.amber94.35.chi
|
||||
share/nab/reslib/dna.amber94/ade.pdb
|
||||
share/nab/reslib/dna.amber94/dna.amber94.qr
|
||||
share/nab/reslib/dna.amber94/dna.amber94.3.qr
|
||||
share/nab/reslib/dna.amber94/dna.amber94.5.qr
|
||||
share/nab/reslib/dna.amber94/dna.amber94.3.bnd
|
||||
share/nab/reslib/dna.amber94/dna.amber94.3.pdb
|
||||
share/nab/reslib/dna.amber94/dna.amber94.pdb
|
||||
share/nab/reslib/dna.amber94/dna.amber94.bnd
|
||||
share/nab/reslib/dna.amber94/dna.amber94.chi
|
||||
share/nab/reslib/dna.amber94/dna.amber94.5.bnd
|
||||
share/nab/reslib/dna.amber94/dna.amber94.5.pdb
|
||||
share/nab/reslib/dna.amber94/dna.amber94_nmr.qr
|
||||
share/nab/reslib/protein.amber94_nmr.rlb
|
||||
share/nab/reslib/protein.amber94.C.rlb
|
||||
share/nab/reslib/rna.amber94/rna.amber94_nmr.3.qr
|
||||
share/nab/reslib/rna.amber94/rna.amber94_nmr.5.qr
|
||||
share/nab/reslib/rna.amber94/rna.amber94.3.qr
|
||||
share/nab/reslib/rna.amber94/rna.amber94.5.qr
|
||||
share/nab/reslib/rna.amber94/rna.amber94.3.pdb
|
||||
share/nab/reslib/rna.amber94/rna.amber94.3.bnd
|
||||
share/nab/reslib/rna.amber94/rna.amber94_nmr.qr
|
||||
share/nab/reslib/rna.amber94/rna.amber94.pdb
|
||||
share/nab/reslib/rna.amber94/rna.amber94.bnd
|
||||
share/nab/reslib/rna.amber94/rna.amber94.chi
|
||||
share/nab/reslib/rna.amber94/rna.amber94.5.pdb
|
||||
share/nab/reslib/rna.amber94/rna.amber94.5.bnd
|
||||
share/nab/reslib/rna.amber94/rna.amber94.qr
|
||||
share/nab/reslib/rna.amberua/rna.amberua.qr
|
||||
share/nab/reslib/rna.amberua/rna.amberua.pdb
|
||||
share/nab/reslib/rna.amberua/rna.amberua.bnd
|
||||
share/nab/reslib/rna.amberua/rna.amberua.chi
|
||||
share/nab/reslib/rna.amberua/rna.amberua.3.qr
|
||||
share/nab/reslib/rna.amberua/rna.amberua.5.qr
|
||||
share/nab/reslib/rna.amberua/rna.amberua.3.pdb
|
||||
share/nab/reslib/rna.amberua/rna.amberua.3.bnd
|
||||
share/nab/reslib/rna.amberua/rna.amberua.5.pdb
|
||||
share/nab/reslib/rna.amberua/rna.amberua.5.bnd
|
||||
share/nab/reslib/dna.amberua/dna.amberua.pdb
|
||||
share/nab/reslib/dna.amberua/dna.amberua.bnd
|
||||
share/nab/reslib/dna.amberua/dna.amberua.chi
|
||||
share/nab/reslib/dna.amberua/dna.amberua.3.qr
|
||||
share/nab/reslib/dna.amberua/dna.amberua.5.qr
|
||||
share/nab/reslib/dna.amberua/dna.amberua.qr
|
||||
share/nab/reslib/dna.amberua/dna.amberua.3.bnd
|
||||
share/nab/reslib/dna.amberua/dna.amberua.3.pdb
|
||||
share/nab/reslib/dna.amberua/dna.amberua.5.bnd
|
||||
share/nab/reslib/dna.amberua/dna.amberua.5.pdb
|
||||
share/nab/reslib/protein.amber94/protein.amber94.NC.chi
|
||||
share/nab/reslib/protein.amber94/protein.amber94.C.qr
|
||||
share/nab/reslib/protein.amber94/protein.amber94.N.qr
|
||||
share/nab/reslib/protein.amber94/protein.amber94.C.pdb
|
||||
share/nab/reslib/protein.amber94/protein.amber94.C.bnd
|
||||
share/nab/reslib/protein.amber94/protein.amber94.qr
|
||||
share/nab/reslib/protein.amber94/protein.amber94.N.pdb
|
||||
share/nab/reslib/protein.amber94/protein.amber94.N.bnd
|
||||
share/nab/reslib/protein.amber94/protein.amber94.chi
|
||||
share/nab/reslib/protein.amber94/protein.amber94.bnd
|
||||
share/nab/reslib/protein.amber94/protein.amber94.pdb
|
||||
share/nab/reslib/protein.amber94/protein.amber94_nmr.qr
|
||||
share/nab/reslib/protein.opls.rlb
|
||||
share/nab/reslib/conf.lib
|
||||
share/nab/reslib/pro-dna.nmr/pro-dna.nmr.star
|
||||
share/nab/reslib/pro-dna.nmr/pro-dna.nmr.input
|
||||
share/nab/reslib/pro-dna.nmr/pro-dna.nmr.off
|
||||
share/nab/reslib/dna.amberua.rlb
|
||||
share/nab/reslib/rna.amberua.rlb
|
||||
share/nab/reslib/protein.amber94.N.rlb
|
||||
share/nab/reslib/rna.amber94_nmr.3.rlb
|
||||
share/nab/reslib/dna.amber94_nmr.3.rlb
|
||||
share/nab/reslib/syblCDD.lib
|
||||
share/nab/reslib/dna.amberua.3.rlb
|
||||
share/nab/reslib/rna.amberua.3.rlb
|
||||
share/nab/reslib/rna.amber94.3.rlb
|
||||
share/nab/reslib/dna.amber94.3.rlb
|
||||
share/nab/reslib/cdd.mol2
|
||||
share/nab/reslib/rna.amber94_nmr.5.rlb
|
||||
share/nab/reslib/dna.amber94_nmr.5.rlb
|
||||
share/nab/reslib/dna.amber94_nmr.rlb
|
||||
share/nab/reslib/protein.amber94.rlb
|
||||
share/nab/reslib/rna.amber94.rlb
|
||||
share/nab/reslib/dna.amber94.rlb
|
||||
share/nab/reslib/dna.amberua.5.rlb
|
||||
share/nab/reslib/rna.amberua.5.rlb
|
||||
share/nab/reslib/rna.amber94.5.rlb
|
||||
share/nab/reslib/dna.amber94.5.rlb
|
||||
share/nab/fd_data/adna.dat
|
||||
share/nab/fd_data/arna.dat
|
||||
share/nab/fd_data/sbdna.dat
|
||||
share/nab/fd_data/abdna.dat
|
||||
share/nab/fd_data/aprna.dat
|
||||
share/nab/fd_data/lbdna.dat
|
||||
share/nab/coords
|
||||
@dirrm share/nab/reslib/pro-dna.nmr
|
||||
@dirrm share/nab/reslib/bdna.std
|
||||
@dirrm share/nab/reslib/protein.opls
|
||||
@dirrm share/nab/reslib/arna.std
|
||||
@dirrm share/nab/reslib/axes
|
||||
@dirrm share/nab/reslib/rna.amber94
|
||||
@dirrm share/nab/reslib/protein.amber94
|
||||
@dirrm share/nab/reslib/dna.amber94
|
||||
@dirrm share/nab/reslib/adna.std
|
||||
@dirrm share/nab/reslib/hetatm.amber94
|
||||
@dirrm share/nab/reslib/dna.amberua
|
||||
@dirrm share/nab/reslib/rna.amberua
|
||||
@dirrm share/nab/reslib/dna3
|
||||
@dirrm share/nab/reslib/leap
|
||||
@dirrm share/nab/reslib
|
||||
@dirrm share/nab/test
|
||||
@dirrm share/nab/examples
|
||||
share/nab/lib/cifparse.a
|
||||
share/nab/lib/libnab.a
|
||||
share/nab/lib/libsym.a
|
||||
share/nab/include/defreal.h
|
||||
share/nab/include/nab.h
|
||||
share/nab/include/nabcode.h
|
||||
share/nab/include/nabtypes.h
|
||||
@dirrm share/doc/nab
|
||||
@dirrm share/nab/bin
|
||||
@dirrm share/nab/lib
|
||||
@dirrm share/nab/include
|
||||
@dirrm share/nab/examples
|
||||
@dirrm share/nab/test
|
||||
@dirrm share/nab/peptide
|
||||
@dirrm share/nab/suppose
|
||||
@dirrm share/nab/dgdb
|
||||
@dirrm share/nab/reslib/hetatm.amber94
|
||||
@dirrm share/nab/reslib/axes
|
||||
@dirrm share/nab/reslib/dna3
|
||||
@dirrm share/nab/reslib/leap
|
||||
@dirrm share/nab/reslib/bdna.std
|
||||
@dirrm share/nab/reslib/arna.std
|
||||
@dirrm share/nab/reslib/adna.std
|
||||
@dirrm share/nab/reslib/protein.opls
|
||||
@dirrm share/nab/reslib/dna.amber94
|
||||
@dirrm share/nab/reslib/rna.amber94
|
||||
@dirrm share/nab/reslib/rna.amberua
|
||||
@dirrm share/nab/reslib/dna.amberua
|
||||
@dirrm share/nab/reslib/protein.amber94
|
||||
@dirrm share/nab/reslib/pro-dna.nmr
|
||||
@dirrm share/nab/reslib
|
||||
@dirrm share/nab/fd_data
|
||||
@dirrm share/nab
|
||||
@dirrm share/doc/nab
|
||||
|
|
|
|||
Loading…
Reference in a new issue