printf ' ' | fink --no-use-binary-dist --yes --build-as-nobody rebuild tinker 2>&1 The package 'tinker' will be built without being installed. Reading build dependency for tinker-6.2.06-1... Reading dependency for tinker-6.2.06-1... Reading build conflict for tinker-6.2.06-1... The package 'gcc48-compiler' will be installed. Reading dependency for gcc48-compiler-4.8.3-1000... Reading runtime dependency for gcc48-compiler-4.8.3-1000... The package 'fftw3' will be installed. Reading dependency for fftw3-3.3.4-2... Reading runtime dependency for fftw3-3.3.4-2... The package 'gcc48-shlibs' will be installed. Reading dependency for gcc48-shlibs-4.8.3-1000... Reading runtime dependency for gcc48-shlibs-4.8.3-1000... The package 'fftw3-shlibs' will be installed. Reading dependency for fftw3-shlibs-3.3.4-2... Reading runtime dependency for fftw3-shlibs-3.3.4-2... The package 'gmp5-shlibs' will be installed. Reading dependency for gmp5-shlibs-6.0.0a-1... Reading runtime dependency for gmp5-shlibs-6.0.0a-1... The package 'libgmpxx5-shlibs' will be installed. Reading dependency for libgmpxx5-shlibs-6.0.0a-1... Reading runtime dependency for libgmpxx5-shlibs-6.0.0a-1... The package 'libmpfr4-shlibs' will be installed. Reading dependency for libmpfr4-shlibs-3.1.2-1... Reading runtime dependency for libmpfr4-shlibs-3.1.2-1... The package 'cloog-org2-shlibs' will be installed. Reading dependency for cloog-org2-shlibs-0.18.2-1... Reading runtime dependency for cloog-org2-shlibs-0.18.2-1... The package 'isl-shlibs' will be installed. Reading dependency for isl-shlibs-0.12.2-2... Reading runtime dependency for isl-shlibs-0.12.2-2... The package 'libmpc3-shlibs' will be installed. Reading dependency for libmpc3-shlibs-1.0.2-1... Reading runtime dependency for libmpc3-shlibs-1.0.2-1... The package 'gcc49-shlibs' will be installed. Reading dependency for gcc49-shlibs-4.9.1-1000... Reading runtime dependency for gcc49-shlibs-4.9.1-1000... The following package will be rebuilt: tinker The following 11 additional packages will be installed: cloog-org2-shlibs fftw3 fftw3-shlibs gcc48-compiler gcc48-shlibs gcc49-shlibs gmp5-shlibs isl-shlibs libgmpxx5-shlibs libmpc3-shlibs libmpfr4-shlibs Do you want to continue? [Y/n] (assuming default) curl --connect-timeout 30 -f -L -A 'fink/0.37.0' -O http://distfiles.master.finkmirrors.net/distfiles/tinker-6.2.06.tar.gz % Total % Received % Xferd Average Speed Time Time Time Current Dload Upload Total Spent Left Speed 0 0 0 0 0 0 0 0 --:--:-- --:--:-- --:--:-- 0 0 0 0 0 0 0 0 0 --:--:-- 0:00:01 --:--:-- 0 0 19.2M 0 1201 0 0 704 0 7:57:47 0:00:01 7:57:46 704 2 19.2M 2 500k 0 0 195k 0 0:01:40 0:00:02 0:01:38 195k 8 19.2M 8 1620k 0 0 456k 0 0:00:43 0:00:03 0:00:40 456k 11 19.2M 11 2335k 0 0 493k 0 0:00:39 0:00:04 0:00:35 492k 15 19.2M 15 3013k 0 0 543k 0 0:00:36 0:00:05 0:00:31 662k 22 19.2M 22 4420k 0 0 673k 0 0:00:29 0:00:06 0:00:23 909k 30 19.2M 30 5968k 0 0 788k 0 0:00:24 0:00:07 0:00:17 1091k 34 19.2M 34 6877k 0 0 787k 0 0:00:25 0:00:08 0:00:17 1014k 36 19.2M 36 7182k 0 0 743k 0 0:00:26 0:00:09 0:00:17 984k 41 19.2M 41 8197k 0 0 751k 0 0:00:26 0:00:10 0:00:16 966k 44 19.2M 44 8810k 0 0 763k 0 0:00:25 0:00:11 0:00:14 880k 46 19.2M 46 9233k 0 0 719k 0 0:00:27 0:00:12 0:00:15 620k 49 19.2M 49 9817k 0 0 724k 0 0:00:27 0:00:13 0:00:14 610k 54 19.2M 54 10.4M 0 0 738k 0 0:00:26 0:00:14 0:00:12 729k 59 19.2M 59 11.4M 0 0 753k 0 0:00:26 0:00:15 0:00:11 759k 62 19.2M 62 12.1M 0 0 736k 0 0:00:26 0:00:16 0:00:10 679k 65 19.2M 65 12.6M 0 0 736k 0 0:00:26 0:00:17 0:00:09 781k 69 19.2M 69 13.4M 0 0 742k 0 0:00:26 0:00:18 0:00:08 789k 74 19.2M 74 14.3M 0 0 752k 0 0:00:26 0:00:19 0:00:07 793k 77 19.2M 77 14.8M 0 0 729k 0 0:00:27 0:00:20 0:00:07 657k 78 19.2M 78 15.1M 0 0 711k 0 0:00:27 0:00:21 0:00:06 626k 83 19.2M 83 15.9M 0 0 725k 0 0:00:27 0:00:22 0:00:05 689k 88 19.2M 88 16.9M 0 0 738k 0 0:00:26 0:00:23 0:00:03 725k 91 19.2M 91 17.5M 0 0 726k 0 0:00:27 0:00:24 0:00:03 627k 92 19.2M 92 17.8M 0 0 691k 0 0:00:28 0:00:26 0:00:02 549k 92 19.2M 92 17.8M 0 0 675k 0 0:00:29 0:00:27 0:00:02 525k 93 19.2M 93 18.0M 0 0 670k 0 0:00:29 0:00:27 0:00:02 419k 100 19.2M 100 19.2M 0 0 691k 0 0:00:28 0:00:28 --:--:-- 467k Reading buildlock packages... All buildlocks accounted for. /sw/bin/dpkg-lockwait -i /sw/fink/dists/stable/main/binary-darwin-x86_64/languages/gcc49-shlibs_4.9.1-1000_darwin-x86_64.deb Selecting previously deselected package gcc49-shlibs. (Reading database ... 4296 files and directories currently installed.) Unpacking gcc49-shlibs (from .../gcc49-shlibs_4.9.1-1000_darwin-x86_64.deb) ... Setting up gcc49-shlibs (4.9.1-1000) ... Clearing dependency_libs of .la files being installed Reading buildlock packages... All buildlocks accounted for. /sw/bin/dpkg-lockwait -i /sw/fink/dists/stable/main/binary-darwin-x86_64/libs/libgmpxx5-shlibs_6.0.0a-1_darwin-x86_64.deb /sw/fink/dists/stable/main/binary-darwin-x86_64/libs/gmp5-shlibs_6.0.0a-1_darwin-x86_64.deb Selecting previously deselected package libgmpxx5-shlibs. (Reading database ... 4341 files and directories currently installed.) Unpacking libgmpxx5-shlibs (from .../libgmpxx5-shlibs_6.0.0a-1_darwin-x86_64.deb) ... Selecting previously deselected package gmp5-shlibs. Unpacking gmp5-shlibs (from .../gmp5-shlibs_6.0.0a-1_darwin-x86_64.deb) ... Setting up gmp5-shlibs (6.0.0a-1) ... Setting up libgmpxx5-shlibs (6.0.0a-1) ... Reading buildlock packages... All buildlocks accounted for. /sw/bin/dpkg-lockwait -i /sw/fink/dists/stable/main/binary-darwin-x86_64/libs/libmpfr4-shlibs_3.1.2-1_darwin-x86_64.deb Selecting previously deselected package libmpfr4-shlibs. (Reading database ... 4370 files and directories currently installed.) Unpacking libmpfr4-shlibs (from .../libmpfr4-shlibs_3.1.2-1_darwin-x86_64.deb) ... Setting up libmpfr4-shlibs (3.1.2-1) ... Reading buildlock packages... All buildlocks accounted for. /sw/bin/dpkg-lockwait -i /sw/fink/debs/fftw3_3.3.4-2_darwin-x86_64.deb /sw/fink/dists/stable/main/binary-darwin-x86_64/sci/fftw3-shlibs_3.3.4-2_darwin-x86_64.deb Selecting previously deselected package fftw3. (Reading database ... 4383 files and directories currently installed.) Unpacking fftw3 (from .../fftw3_3.3.4-2_darwin-x86_64.deb) ... Selecting previously deselected package fftw3-shlibs. Unpacking fftw3-shlibs (from .../fftw3-shlibs_3.3.4-2_darwin-x86_64.deb) ... Setting up fftw3-shlibs (3.3.4-2) ... Setting up fftw3 (3.3.4-2) ... Clearing dependency_libs of .la files being installed * fftw3: (fftw3). FFTW User's Manual. install-info(/sw/share/info/fftw3.info): creating new section `Development' Reading buildlock packages... All buildlocks accounted for. /sw/bin/dpkg-lockwait -i /sw/fink/dists/stable/main/binary-darwin-x86_64/devel/isl-shlibs_0.12.2-2_darwin-x86_64.deb Selecting previously deselected package isl-shlibs. (Reading database ... 4568 files and directories currently installed.) Unpacking isl-shlibs (from .../isl-shlibs_0.12.2-2_darwin-x86_64.deb) ... Setting up isl-shlibs (0.12.2-2) ... Reading buildlock packages... All buildlocks accounted for. /sw/bin/dpkg-lockwait -i /sw/fink/dists/stable/main/binary-darwin-x86_64/libs/libmpc3-shlibs_1.0.2-1_darwin-x86_64.deb Selecting previously deselected package libmpc3-shlibs. (Reading database ... 4569 files and directories currently installed.) Unpacking libmpc3-shlibs (from .../libmpc3-shlibs_1.0.2-1_darwin-x86_64.deb) ... Setting up libmpc3-shlibs (1.0.2-1) ... Reading buildlock packages... All buildlocks accounted for. /sw/bin/dpkg-lockwait -i /sw/fink/dists/stable/main/binary-darwin-x86_64/devel/cloog-org2-shlibs_0.18.2-1_darwin-x86_64.deb Selecting previously deselected package cloog-org2-shlibs. (Reading database ... 4572 files and directories currently installed.) Unpacking cloog-org2-shlibs (from .../cloog-org2-shlibs_0.18.2-1_darwin-x86_64.deb) ... Setting up cloog-org2-shlibs (0.18.2-1) ... Reading buildlock packages... All buildlocks accounted for. /sw/bin/dpkg-lockwait -i /sw/fink/dists/stable/main/binary-darwin-x86_64/languages/gcc48-compiler_4.8.3-1000_darwin-x86_64.deb /sw/fink/dists/stable/main/binary-darwin-x86_64/languages/gcc48-shlibs_4.8.3-1000_darwin-x86_64.deb Selecting previously deselected package gcc48-compiler. (Reading database ... 4573 files and directories currently installed.) Unpacking gcc48-compiler (from .../gcc48-compiler_4.8.3-1000_darwin-x86_64.deb) ... Selecting previously deselected package gcc48-shlibs. Unpacking gcc48-shlibs (from .../gcc48-shlibs_4.8.3-1000_darwin-x86_64.deb) ... Setting up gcc48-shlibs (4.8.3-1000) ... Clearing dependency_libs of .la files being installed Setting up gcc48-compiler (4.8.3-1000) ... Clearing dependency_libs of .la files being installed Setting runtime build-lock... dpkg-deb -b /sw/build.build/root-fink-buildlock-tinker-6.2.06-1 /sw/build.build dpkg-deb: building package `fink-buildlock-tinker-6.2.06-1' in `/sw/build.build/fink-buildlock-tinker-6.2.06-1_2014.07.31-23.52.44_darwin-x86_64.deb'. Installing build-lock package... /sw/bin/dpkg-lockwait -i /sw/build.build/fink-buildlock-tinker-6.2.06-1_2014.07.31-23.52.44_darwin-x86_64.deb Selecting previously deselected package fink-buildlock-tinker-6.2.06-1. (Reading database ... 9993 files and directories currently installed.) Unpacking fink-buildlock-tinker-6.2.06-1 (from .../fink-buildlock-tinker-6.2.06-1_2014.07.31-23.52.44_darwin-x86_64.deb) ... Setting up fink-buildlock-tinker-6.2.06-1 (2014.07.31-23.52.44) ... sudo -u fink-bld [ENV] sh -c /tmp/fink.Hufbz env LANG=C LC_ALL=C /sw/bin/tar --no-same-owner --no-same-permissions -xvf /sw/src/tinker-6.2.06.tar.gz tinker/ tinker/bench/ tinker/configure/ tinker/doc/ tinker/example/ tinker/fftw/ tinker/linux/ tinker/macosx/ tinker/make/ tinker/mmff/ tinker/other/ tinker/params/ tinker/perl/ tinker/source/ tinker/test/ tinker/unix/ tinker/windows/ tinker/windows/compaq/ tinker/windows/cygwin/ tinker/windows/intel/ tinker/windows/lahey/ tinker/windows/lahey/0README tinker/windows/lahey/compile.bat tinker/windows/lahey/library.bat tinker/windows/lahey/library.lbc tinker/windows/lahey/links.bat tinker/windows/lahey/rename.make tinker/windows/lahey/unzip.make tinker/windows/lahey/zip.make tinker/windows/intel/0README tinker/windows/intel/compgui.bat tinker/windows/intel/compile.bat tinker/windows/intel/editbin.make tinker/windows/intel/generic.bat tinker/windows/intel/library.bat tinker/windows/intel/library.lbc tinker/windows/intel/linkgui.bat tinker/windows/intel/links.bat tinker/windows/intel/listing.bat tinker/windows/intel/rename.make tinker/windows/intel/unzip.make tinker/windows/intel/zip.make tinker/windows/cygwin/0README tinker/windows/cygwin/compile.make tinker/windows/cygwin/library.make tinker/windows/cygwin/link.make tinker/windows/cygwin/listing.make tinker/windows/cygwin/rename.make tinker/windows/compaq/0README tinker/windows/compaq/command.f tinker/windows/compaq/compile.bat tinker/windows/compaq/library.bat tinker/windows/compaq/library.lbc tinker/windows/compaq/links.bat tinker/windows/compaq/listing.bat tinker/windows/compaq/rename.make tinker/windows/compaq/unzip.make tinker/windows/compaq/zip.make tinker/unix/0README tinker/unix/alpha/ tinker/unix/hpux/ tinker/unix/ibmaix/ tinker/unix/sgi/ tinker/unix/sun/ tinker/unix/sun/0README tinker/unix/sun/compile.make tinker/unix/sun/library.make tinker/unix/sun/link.make tinker/unix/sun/listing.make tinker/unix/sun/rename.make tinker/unix/sgi/0README tinker/unix/sgi/compile.make tinker/unix/sgi/library.make tinker/unix/sgi/link.make tinker/unix/sgi/listing.make tinker/unix/sgi/rename.make tinker/unix/ibmaix/0README tinker/unix/ibmaix/compile.make tinker/unix/ibmaix/library.make tinker/unix/ibmaix/link.make tinker/unix/ibmaix/listing.make tinker/unix/ibmaix/rename.make tinker/unix/hpux/0README tinker/unix/hpux/compile.make tinker/unix/hpux/library.make tinker/unix/hpux/link.make tinker/unix/hpux/listing.make tinker/unix/hpux/rename.make tinker/unix/alpha/0README tinker/unix/alpha/compile.make tinker/unix/alpha/library.make tinker/unix/alpha/link.make tinker/unix/alpha/listing.make tinker/unix/alpha/rename.make tinker/test/0README tinker/test/anion.dat tinker/test/anion.dyn0 tinker/test/anion.key tinker/test/anion.log tinker/test/anion.run tinker/test/anion.xyz tinker/test/argon.1st tinker/test/argon.key tinker/test/argon.log tinker/test/argon.run tinker/test/cluster.dat tinker/test/cluster.key tinker/test/cluster.log tinker/test/cluster.run tinker/test/cluster.xyz tinker/test/crambin.key tinker/test/crambin.log tinker/test/crambin.pdb tinker/test/crambin.run tinker/test/cyclohex.boat tinker/test/cyclohex.chair tinker/test/cyclohex.key tinker/test/cyclohex.log tinker/test/cyclohex.run tinker/test/dhfr.dyn tinker/test/dhfr.key tinker/test/dhfr.log tinker/test/dhfr.run tinker/test/dhfr.xyz tinker/test/dialanine.key tinker/test/dialanine.log tinker/test/dialanine.run tinker/test/dialanine.xyz tinker/test/enkephalin.dat tinker/test/enkephalin.key tinker/test/enkephalin.log tinker/test/enkephalin.run tinker/test/ethanol.000 tinker/test/ethanol.020 tinker/test/ethanol.040 tinker/test/ethanol.060 tinker/test/ethanol.080 tinker/test/ethanol.100 tinker/test/ethanol.120 tinker/test/ethanol.140 tinker/test/ethanol.160 tinker/test/ethanol.180 tinker/test/ethanol.dat tinker/test/ethanol.key tinker/test/ethanol.log tinker/test/ethanol.run tinker/test/ethanol.xyz tinker/test/formamide.cell tinker/test/formamide.dat tinker/test/formamide.key tinker/test/formamide.log tinker/test/formamide.run tinker/test/gpcr.blk tinker/test/gpcr.key tinker/test/gpcr.log tinker/test/gpcr.run tinker/test/gpcr.xyz tinker/test/helix.1st tinker/test/helix.key tinker/test/helix.log tinker/test/helix.run tinker/test/ice.key tinker/test/ice.log tinker/test/ice.run tinker/test/ice.xyz tinker/test/ifabp.dat tinker/test/ifabp.key tinker/test/ifabp.log tinker/test/ifabp.run tinker/test/ifabp.xyz tinker/test/salt.cell tinker/test/salt.key tinker/test/salt.log tinker/test/salt.run tinker/test/tetraala.dat tinker/test/tetraala.key tinker/test/tetraala.log tinker/test/tetraala.run tinker/test/water.key tinker/test/water.log tinker/test/water.pot tinker/test/water.run tinker/test/water.xyz tinker/source/0README tinker/source/action.i tinker/source/active.f tinker/source/alchemy.f tinker/source/align.i tinker/source/analysis.f tinker/source/analyz.i tinker/source/analyze.f tinker/source/angang.i tinker/source/angle.i tinker/source/angles.f tinker/source/angpot.i tinker/source/anneal.f tinker/source/archive.f tinker/source/argue.i tinker/source/ascii.i tinker/source/atmlst.i tinker/source/atmtyp.i tinker/source/atoms.i tinker/source/attach.f tinker/source/bar.f tinker/source/basefile.f tinker/source/bath.i tinker/source/beeman.f tinker/source/bicubic.f tinker/source/bitor.i tinker/source/bitors.f tinker/source/bndpot.i tinker/source/bond.i tinker/source/bonds.f tinker/source/border.i tinker/source/born.f tinker/source/bound.i tinker/source/bounds.f tinker/source/boxes.i tinker/source/bussi.f tinker/source/calendar.f tinker/source/cell.i tinker/source/center.f tinker/source/charge.i tinker/source/chgpot.i tinker/source/chkpole.f tinker/source/chkring.f tinker/source/chkxyz.f tinker/source/cholesky.f tinker/source/chrono.i tinker/source/chunks.i tinker/source/clock.f tinker/source/cluster.f tinker/source/column.f tinker/source/command.f tinker/source/connect.f tinker/source/connolly.f tinker/source/control.f tinker/source/correlate.f tinker/source/couple.i tinker/source/crystal.f tinker/source/cspline.f tinker/source/cutoff.i tinker/source/cutoffs.f tinker/source/deflate.f tinker/source/delete.f tinker/source/deriv.i tinker/source/diagq.f tinker/source/diffeq.f tinker/source/diffuse.f tinker/source/dipole.i tinker/source/disgeo.i tinker/source/distgeom.f tinker/source/dma.i tinker/source/document.f tinker/source/domega.i tinker/source/dynamic.f tinker/source/eangang.f tinker/source/eangang1.f tinker/source/eangang2.f tinker/source/eangang3.f tinker/source/eangle.f tinker/source/eangle1.f tinker/source/eangle2.f tinker/source/eangle3.f tinker/source/ebond.f tinker/source/ebond1.f tinker/source/ebond2.f tinker/source/ebond3.f tinker/source/ebuck.f tinker/source/ebuck1.f tinker/source/ebuck2.f tinker/source/ebuck3.f tinker/source/echarge.f tinker/source/echarge1.f tinker/source/echarge2.f tinker/source/echarge3.f tinker/source/echgdpl.f tinker/source/echgdpl1.f tinker/source/echgdpl2.f tinker/source/echgdpl3.f tinker/source/edipole.f tinker/source/edipole1.f tinker/source/edipole2.f tinker/source/edipole3.f tinker/source/egauss.f tinker/source/egauss1.f tinker/source/egauss2.f tinker/source/egauss3.f tinker/source/egeom.f tinker/source/egeom1.f tinker/source/egeom2.f tinker/source/egeom3.f tinker/source/ehal.f tinker/source/ehal1.f tinker/source/ehal2.f tinker/source/ehal3.f tinker/source/eimprop.f tinker/source/eimprop1.f tinker/source/eimprop2.f tinker/source/eimprop3.f tinker/source/eimptor.f tinker/source/eimptor1.f tinker/source/eimptor2.f tinker/source/eimptor3.f tinker/source/elj.f tinker/source/elj1.f tinker/source/elj2.f tinker/source/elj3.f tinker/source/embed.f tinker/source/emetal.f tinker/source/emetal1.f tinker/source/emetal2.f tinker/source/emetal3.f tinker/source/emm3hb.f tinker/source/emm3hb1.f tinker/source/emm3hb2.f tinker/source/emm3hb3.f tinker/source/empole.f tinker/source/empole1.f tinker/source/empole2.f tinker/source/empole3.f tinker/source/energi.i tinker/source/energy.f tinker/source/eopbend.f tinker/source/eopbend1.f tinker/source/eopbend2.f tinker/source/eopbend3.f tinker/source/eopdist.f tinker/source/eopdist1.f tinker/source/eopdist2.f tinker/source/eopdist3.f tinker/source/epitors.f tinker/source/epitors1.f tinker/source/epitors2.f tinker/source/epitors3.f tinker/source/erf.f tinker/source/erxnfld.f tinker/source/erxnfld1.f tinker/source/erxnfld2.f tinker/source/erxnfld3.f tinker/source/esolv.f tinker/source/esolv1.f tinker/source/esolv2.f tinker/source/esolv3.f tinker/source/estrbnd.f tinker/source/estrbnd1.f tinker/source/estrbnd2.f tinker/source/estrbnd3.f tinker/source/estrtor.f tinker/source/estrtor1.f tinker/source/estrtor2.f tinker/source/estrtor3.f tinker/source/etors.f tinker/source/etors1.f tinker/source/etors2.f tinker/source/etors3.f tinker/source/etortor.f tinker/source/etortor1.f tinker/source/etortor2.f tinker/source/etortor3.f tinker/source/eurey.f tinker/source/eurey1.f tinker/source/eurey2.f tinker/source/eurey3.f tinker/source/evcorr.f tinker/source/ewald.i tinker/source/extra.f tinker/source/extra1.f tinker/source/extra2.f tinker/source/extra3.f tinker/source/faces.i tinker/source/fatal.f tinker/source/fft.i tinker/source/fft3d.f tinker/source/fftpack.f tinker/source/field.f tinker/source/fields.i tinker/source/files.i tinker/source/final.f tinker/source/flatten.f tinker/source/fracs.i tinker/source/freeunit.f tinker/source/freeze.i tinker/source/gda.f tinker/source/geometry.f tinker/source/getint.f tinker/source/getkey.f tinker/source/getmol.f tinker/source/getmol2.f tinker/source/getnumb.f tinker/source/getpdb.f tinker/source/getprm.f tinker/source/getref.f tinker/source/getstring.f tinker/source/gettext.f tinker/source/getword.f tinker/source/getxyz.f tinker/source/ghmcstep.f tinker/source/gkstuf.i tinker/source/gradient.f tinker/source/gradrgd.f tinker/source/gradrot.f tinker/source/group.i tinker/source/groups.f tinker/source/grpline.f tinker/source/gyrate.f tinker/source/hescut.i tinker/source/hessian.f tinker/source/hessn.i tinker/source/hessrgd.f tinker/source/hessrot.f tinker/source/hpmf.i tinker/source/hybrid.f tinker/source/image.f tinker/source/impose.f tinker/source/improp.i tinker/source/imptor.i tinker/source/induce.f tinker/source/inertia.f tinker/source/inform.i tinker/source/initatom.f tinker/source/initial.f tinker/source/initprm.f tinker/source/initres.f tinker/source/initrot.f tinker/source/insert.f tinker/source/intedit.f tinker/source/inter.i tinker/source/intxyz.f tinker/source/invbeta.f tinker/source/invert.f tinker/source/iounit.i tinker/source/jacobi.f tinker/source/kanang.i tinker/source/kangang.f tinker/source/kangle.f tinker/source/kangs.i tinker/source/katom.f tinker/source/katoms.i tinker/source/kbond.f tinker/source/kbonds.i tinker/source/kcharge.f tinker/source/kchrge.i tinker/source/kdipol.i tinker/source/kdipole.f tinker/source/kewald.f tinker/source/kextra.f tinker/source/keys.i tinker/source/kgeom.f tinker/source/kgeoms.i tinker/source/khbond.i tinker/source/kimprop.f tinker/source/kimptor.f tinker/source/kinetic.f tinker/source/kiprop.i tinker/source/kitors.i tinker/source/kmetal.f tinker/source/kmpole.f tinker/source/kmulti.i tinker/source/kopbend.f tinker/source/kopbnd.i tinker/source/kopdist.f tinker/source/kopdst.i tinker/source/korbit.f tinker/source/korbs.i tinker/source/kpitor.i tinker/source/kpitors.f tinker/source/kpolar.f tinker/source/kpolr.i tinker/source/ksolv.f tinker/source/kstbnd.i tinker/source/kstrbnd.f tinker/source/kstrtor.f tinker/source/ksttor.i tinker/source/ktors.f tinker/source/ktorsn.i tinker/source/ktortor.f tinker/source/ktrtor.i tinker/source/kurey.f tinker/source/kurybr.i tinker/source/kvdw.f tinker/source/kvdwpr.i tinker/source/kvdws.i tinker/source/lattice.f tinker/source/lbfgs.f tinker/source/light.i tinker/source/lights.f tinker/source/linmin.i tinker/source/makeint.f tinker/source/makeref.f tinker/source/makexyz.f tinker/source/math.i tinker/source/maxwell.f tinker/source/mdinit.f tinker/source/mdrest.f tinker/source/mdsave.f tinker/source/mdstat.f tinker/source/mdstuf.i tinker/source/mechanic.f tinker/source/merck.i tinker/source/merge.f tinker/source/minima.i tinker/source/minimize.f tinker/source/minirot.f tinker/source/minrigid.f tinker/source/molcul.i tinker/source/moldyn.i tinker/source/molecule.f tinker/source/molxyz.f tinker/source/moment.i tinker/source/moments.f tinker/source/monte.f tinker/source/mplpot.i tinker/source/mpole.i tinker/source/mutant.i tinker/source/mutate.f tinker/source/nblist.f tinker/source/neigh.i tinker/source/newton.f tinker/source/newtrot.f tinker/source/nextarg.f tinker/source/nexttext.f tinker/source/nose.f tinker/source/npolar.i tinker/source/nspline.f tinker/source/nucleic.f tinker/source/nucleo.i tinker/source/number.f tinker/source/numeral.f tinker/source/numgrad.f tinker/source/ocvm.f tinker/source/omega.i tinker/source/opbend.i tinker/source/opdist.i tinker/source/openend.f tinker/source/openmp.i tinker/source/optimize.f tinker/source/optirot.f tinker/source/optrigid.f tinker/source/optsave.f tinker/source/orbital.f tinker/source/orbits.i tinker/source/orient.f tinker/source/orthog.f tinker/source/output.i tinker/source/overlap.f tinker/source/params.i tinker/source/path.f tinker/source/paths.i tinker/source/pbstuf.i tinker/source/pdb.i tinker/source/pdbxyz.f tinker/source/phipsi.i tinker/source/picalc.f tinker/source/piorbs.i tinker/source/pistuf.i tinker/source/pitors.i tinker/source/pme.i tinker/source/pmestuff.f tinker/source/pmpb.c tinker/source/pmpb.f tinker/source/polar.i tinker/source/polarize.f tinker/source/poledit.f tinker/source/polgrp.i tinker/source/polpot.i tinker/source/polymer.f tinker/source/potent.i tinker/source/potential.f tinker/source/potfit.i tinker/source/precis.i tinker/source/precise.f tinker/source/pressure.f tinker/source/prmedit.f tinker/source/prmkey.f tinker/source/promo.f tinker/source/protein.f tinker/source/prtdyn.f tinker/source/prterr.f tinker/source/prtint.f tinker/source/prtmol2.f tinker/source/prtpdb.f tinker/source/prtprm.f tinker/source/prtseq.f tinker/source/prtxyz.f tinker/source/pss.f tinker/source/pssrigid.f tinker/source/pssrot.f tinker/source/ptable.i tinker/source/qmstuf.i tinker/source/quatfit.f tinker/source/radial.f tinker/source/random.f tinker/source/rattle.f tinker/source/readdyn.f tinker/source/readgau.f tinker/source/readint.f tinker/source/readmol.f tinker/source/readmol2.f tinker/source/readpdb.f tinker/source/readprm.f tinker/source/readseq.f tinker/source/readxyz.f tinker/source/refer.i tinker/source/replica.f tinker/source/resdue.i tinker/source/respa.f tinker/source/rgddyn.i tinker/source/rgdstep.f tinker/source/rigid.i tinker/source/ring.i tinker/source/rings.f tinker/source/rmsfit.f tinker/source/rotate.i tinker/source/rotlist.f tinker/source/rotpole.f tinker/source/rxnfld.i tinker/source/rxnpot.i tinker/source/saddle.f tinker/source/scales.i tinker/source/scan.f tinker/source/sdstep.f tinker/source/search.f tinker/source/sequen.i tinker/source/server.c tinker/source/server.f tinker/source/shakeup.f tinker/source/shunt.i tinker/source/sigmoid.f tinker/source/sizes.i tinker/source/sktstuff.f tinker/source/sniffer.f tinker/source/socket.i tinker/source/solute.i tinker/source/sort.f tinker/source/spacefill.f tinker/source/spectrum.f tinker/source/square.f tinker/source/stodyn.i tinker/source/strbnd.i tinker/source/strtor.i tinker/source/suffix.f tinker/source/superpose.f tinker/source/surface.f tinker/source/surfatom.f tinker/source/switch.f tinker/source/sybylxyz.f tinker/source/syntrn.i tinker/source/temper.f tinker/source/testgrad.f tinker/source/testhess.f tinker/source/testpair.f tinker/source/testpol.f tinker/source/testrot.f tinker/source/timer.f tinker/source/timerot.f tinker/source/titles.i tinker/source/tncg.f tinker/source/torphase.f tinker/source/torpot.i tinker/source/torque.f tinker/source/tors.i tinker/source/torsfit.f tinker/source/torsions.f tinker/source/tortor.i tinker/source/tree.i tinker/source/trimtext.f tinker/source/unitcell.f tinker/source/units.i tinker/source/uprior.i tinker/source/urey.i tinker/source/urypot.i tinker/source/usage.i tinker/source/usolve.i tinker/source/valence.f tinker/source/valfit.i tinker/source/vdw.i tinker/source/vdwpot.i tinker/source/verlet.f tinker/source/version.f tinker/source/vibbig.f tinker/source/vibrate.f tinker/source/vibrot.f tinker/source/vibs.i tinker/source/virial.i tinker/source/volume.f tinker/source/warp.i tinker/source/xtalfit.f tinker/source/xtalmin.f tinker/source/xtals.i tinker/source/xyzatm.f tinker/source/xyzedit.f tinker/source/xyzint.f tinker/source/xyzpdb.f tinker/source/xyzsybyl.f tinker/source/zatom.f tinker/source/zclose.i tinker/source/zcoord.i tinker/perl/bar tinker/perl/bar2 tinker/perl/mdavg tinker/perl/octahedron tinker/perl/s-transrot tinker/perl/s-vib tinker/perl/traceless tinker/params/0README tinker/params/amber94.prm tinker/params/amber96.prm tinker/params/amber98.prm tinker/params/amber99.prm tinker/params/amber99sb.prm tinker/params/amoeba04.prm tinker/params/amoeba09.prm tinker/params/amoebabio09.prm tinker/params/amoebapro04.prm tinker/params/amoebapro13.prm tinker/params/charmm19.prm tinker/params/charmm22.prm tinker/params/charmm22cmap.prm tinker/params/dang.prm tinker/params/hoch.prm tinker/params/iwater.prm tinker/params/mm2.prm tinker/params/mm3.prm tinker/params/mm3pro.prm tinker/params/mmff.prm tinker/params/oplsaa.prm tinker/params/oplsaal.prm tinker/params/oplsua.prm tinker/params/smoothaa.prm tinker/params/smoothua.prm tinker/params/tiny.prm tinker/params/water.prm tinker/other/agda.f tinker/other/barkema.f tinker/other/beeman.4site tinker/other/beeman.5site tinker/other/biotypes.txt tinker/other/buildframe.f tinker/other/distgeom.part tinker/other/download.f tinker/other/drotpole.f tinker/other/dudek.f tinker/other/ebond4.f tinker/other/embed.old tinker/other/empole.taper tinker/other/empole1.taper tinker/other/empole3.taper tinker/other/eopbend.alt tinker/other/eopbend.orig tinker/other/eopbend2.full tinker/other/epolar.f tinker/other/erf.alt tinker/other/erxnfld.full tinker/other/erxnfld.new tinker/other/erxnfld3.new tinker/other/euler.f tinker/other/ewca.f tinker/other/ewreg.f tinker/other/extent.f tinker/other/fakenoe.f tinker/other/fft3d.fftpack tinker/other/flory.f tinker/other/formatsb.f tinker/other/getreal.f tinker/other/header.f tinker/other/hessfull.f tinker/other/hessian.f tinker/other/image.alt tinker/other/lmqn.f tinker/other/makeopls.f tinker/other/mdstat.thg tinker/other/mlgrid.f tinker/other/mlgrids.f tinker/other/moveaxes.f tinker/other/movie.f tinker/other/mslave.f tinker/other/muller.f tinker/other/nblist.alt tinker/other/neighbor.f tinker/other/noesetup.f tinker/other/nuclion.f tinker/other/palmer.f tinker/other/pmepol.f tinker/other/pmpb.old tinker/other/ptensor.f tinker/other/radial.cycle tinker/other/reorder.f tinker/other/respa.pv tinker/other/respa.vv tinker/other/respit.f tinker/other/rotlist.alt tinker/other/shake.f tinker/other/simplex.f tinker/other/sincos.f tinker/other/t2matrix.f tinker/other/testpres.f tinker/other/trngl.f tinker/other/trudge.f tinker/other/tsplit.f tinker/other/vibrigid.f tinker/other/virial2.f tinker/other/xtalhess.f tinker/other/xtalmin.alt tinker/other/xyzplot.f tinker/mmff/0README tinker/mmff/info.pdf tinker/make/0README tinker/make/depend.make tinker/make/Makefile tinker/macosx/absoft/ tinker/macosx/g95/ tinker/macosx/gfortran/ tinker/macosx/intel/ tinker/macosx/pgi/ tinker/macosx/pgi/0README tinker/macosx/pgi/compile.make tinker/macosx/pgi/library.make tinker/macosx/pgi/link.make tinker/macosx/pgi/listing.make tinker/macosx/pgi/rename.make tinker/macosx/intel/0README tinker/macosx/intel/compapbs.make tinker/macosx/intel/compile.make tinker/macosx/intel/compopt.make tinker/macosx/intel/compprof.make tinker/macosx/intel/compserial.make tinker/macosx/intel/debug.make tinker/macosx/intel/library.make tinker/macosx/intel/link.make tinker/macosx/intel/linkapbs.make tinker/macosx/intel/linkd.make tinker/macosx/intel/linkopt.make tinker/macosx/intel/linkprof.make tinker/macosx/intel/linkserial.make tinker/macosx/intel/listing.make tinker/macosx/intel/rename.make tinker/macosx/gfortran/0README tinker/macosx/gfortran/compgui.make tinker/macosx/gfortran/compile.make tinker/macosx/gfortran/library.make tinker/macosx/gfortran/link.make tinker/macosx/gfortran/linkgui.make tinker/macosx/gfortran/listing.make tinker/macosx/gfortran/rename.make tinker/macosx/g95/0README tinker/macosx/g95/compgui.make tinker/macosx/g95/compile.make tinker/macosx/g95/library.make tinker/macosx/g95/link.make tinker/macosx/g95/linkgui.make tinker/macosx/g95/listing.make tinker/macosx/g95/rename.make tinker/macosx/absoft/0README tinker/macosx/absoft/absoft.f tinker/macosx/absoft/compile.make tinker/macosx/absoft/library.make tinker/macosx/absoft/link.make tinker/macosx/absoft/listing.make tinker/macosx/absoft/rename.make tinker/linux/absoft/ tinker/linux/g95/ tinker/linux/gfortran/ tinker/linux/intel/ tinker/linux/pathscale/ tinker/linux/pgi/ tinker/linux/pgi/0README tinker/linux/pgi/compile.make tinker/linux/pgi/debug.make tinker/linux/pgi/library.make tinker/linux/pgi/link.make tinker/linux/pgi/linkd.make tinker/linux/pgi/listing.make tinker/linux/pgi/openend.f tinker/linux/pgi/rename.make tinker/linux/pgi/static.make tinker/linux/pathscale/0README tinker/linux/pathscale/compile.make tinker/linux/pathscale/library.make tinker/linux/pathscale/link.make tinker/linux/pathscale/listing.make tinker/linux/pathscale/rename.make tinker/linux/intel/0README tinker/linux/intel/compapbs.make tinker/linux/intel/compgui.make tinker/linux/intel/compile.make tinker/linux/intel/compopt.make tinker/linux/intel/compserial.make tinker/linux/intel/debug.make tinker/linux/intel/generic.make tinker/linux/intel/library.make tinker/linux/intel/link.make tinker/linux/intel/linkapbs.make tinker/linux/intel/linkd.make tinker/linux/intel/linkgui.make tinker/linux/intel/linkopt.make tinker/linux/intel/linkserial.make tinker/linux/intel/listing.make tinker/linux/intel/rename.make tinker/linux/gfortran/0README tinker/linux/gfortran/compile.make tinker/linux/gfortran/library.make tinker/linux/gfortran/link.make tinker/linux/gfortran/listing.make tinker/linux/gfortran/rename.make tinker/linux/g95/0README tinker/linux/g95/compile.make tinker/linux/g95/library.make tinker/linux/g95/link.make tinker/linux/g95/listing.make tinker/linux/g95/rename.make tinker/linux/absoft/0README tinker/linux/absoft/absoft.f tinker/linux/absoft/compile.make tinker/linux/absoft/library.make tinker/linux/absoft/link.make tinker/linux/absoft/listing.make tinker/linux/absoft/rename.make tinker/fftw/0README tinker/fftw/aclocal.m4 tinker/fftw/api/ tinker/fftw/AUTHORS tinker/fftw/bootstrap.sh tinker/fftw/ChangeLog tinker/fftw/compile tinker/fftw/config.guess tinker/fftw/config.h.in tinker/fftw/config.sub tinker/fftw/configure tinker/fftw/configure-linux tinker/fftw/configure-macosx tinker/fftw/configure-orig tinker/fftw/configure.ac tinker/fftw/CONVENTIONS tinker/fftw/COPYING tinker/fftw/COPYRIGHT tinker/fftw/depcomp tinker/fftw/dft/ tinker/fftw/doc/ tinker/fftw/fftw.pc.in tinker/fftw/genfft/ tinker/fftw/INSTALL tinker/fftw/install-sh tinker/fftw/kernel/ tinker/fftw/libbench2/ tinker/fftw/ltmain.sh tinker/fftw/m4/ tinker/fftw/Makefile.am tinker/fftw/Makefile.in tinker/fftw/missing tinker/fftw/mpi/ tinker/fftw/NEWS tinker/fftw/rdft/ tinker/fftw/README tinker/fftw/reodft/ tinker/fftw/simd-support/ tinker/fftw/support/ tinker/fftw/tests/ tinker/fftw/threads/ tinker/fftw/TODO tinker/fftw/tools/ tinker/fftw/tools/fftw-wisdom-to-conf.1 tinker/fftw/tools/fftw-wisdom-to-conf.in tinker/fftw/tools/fftw-wisdom.c tinker/fftw/tools/fftw_wisdom.1.in tinker/fftw/tools/fftwf-wisdom.1 tinker/fftw/tools/Makefile.am tinker/fftw/tools/Makefile.in tinker/fftw/threads/api.c tinker/fftw/threads/conf.c tinker/fftw/threads/ct.c tinker/fftw/threads/dft-vrank-geq1.c tinker/fftw/threads/f77api.c tinker/fftw/threads/f77funcs.h tinker/fftw/threads/hc2hc.c tinker/fftw/threads/Makefile.am tinker/fftw/threads/Makefile.in tinker/fftw/threads/openmp.c tinker/fftw/threads/rdft-vrank-geq1.c tinker/fftw/threads/threads.c tinker/fftw/threads/threads.h tinker/fftw/threads/vrank-geq1-rdft2.c tinker/fftw/tests/bench.c tinker/fftw/tests/check.pl tinker/fftw/tests/fftw-bench.c tinker/fftw/tests/fftw-bench.h tinker/fftw/tests/hook.c tinker/fftw/tests/Makefile.am tinker/fftw/tests/Makefile.in tinker/fftw/tests/README tinker/fftw/support/addchain.c tinker/fftw/support/codelet_prelude.dft tinker/fftw/support/codelet_prelude.rdft tinker/fftw/support/Makefile.am tinker/fftw/support/Makefile.codelets tinker/fftw/support/Makefile.in tinker/fftw/support/twovers.sh tinker/fftw/simd-support/altivec.c tinker/fftw/simd-support/amd64-cpuid.h tinker/fftw/simd-support/avx.c tinker/fftw/simd-support/Makefile.am tinker/fftw/simd-support/Makefile.in tinker/fftw/simd-support/neon.c tinker/fftw/simd-support/simd-altivec.h tinker/fftw/simd-support/simd-avx.h tinker/fftw/simd-support/simd-common.h tinker/fftw/simd-support/simd-neon.h tinker/fftw/simd-support/simd-sse2.h tinker/fftw/simd-support/sse2-nonportable.c tinker/fftw/simd-support/sse2.c tinker/fftw/simd-support/taint.c tinker/fftw/simd-support/x86-cpuid.h tinker/fftw/reodft/conf.c tinker/fftw/reodft/Makefile.am tinker/fftw/reodft/Makefile.in tinker/fftw/reodft/redft00e-r2hc-pad.c tinker/fftw/reodft/redft00e-r2hc.c tinker/fftw/reodft/reodft.h tinker/fftw/reodft/reodft00e-splitradix.c tinker/fftw/reodft/reodft010e-r2hc.c tinker/fftw/reodft/reodft11e-r2hc-odd.c tinker/fftw/reodft/reodft11e-r2hc.c tinker/fftw/reodft/reodft11e-radix2.c tinker/fftw/reodft/rodft00e-r2hc-pad.c tinker/fftw/reodft/rodft00e-r2hc.c tinker/fftw/rdft/buffered.c tinker/fftw/rdft/buffered2.c tinker/fftw/rdft/codelet-rdft.h tinker/fftw/rdft/conf.c tinker/fftw/rdft/ct-hc2c-direct.c tinker/fftw/rdft/ct-hc2c.c tinker/fftw/rdft/ct-hc2c.h tinker/fftw/rdft/dft-r2hc.c tinker/fftw/rdft/dht-r2hc.c tinker/fftw/rdft/dht-rader.c tinker/fftw/rdft/direct-r2c.c tinker/fftw/rdft/direct-r2r.c tinker/fftw/rdft/direct2.c tinker/fftw/rdft/generic.c tinker/fftw/rdft/hc2hc-direct.c tinker/fftw/rdft/hc2hc-generic.c tinker/fftw/rdft/hc2hc.c tinker/fftw/rdft/hc2hc.h tinker/fftw/rdft/indirect.c tinker/fftw/rdft/khc2c.c tinker/fftw/rdft/khc2hc.c tinker/fftw/rdft/kr2c.c tinker/fftw/rdft/kr2r.c tinker/fftw/rdft/Makefile.am tinker/fftw/rdft/Makefile.in tinker/fftw/rdft/nop.c tinker/fftw/rdft/nop2.c tinker/fftw/rdft/plan.c tinker/fftw/rdft/plan2.c tinker/fftw/rdft/problem.c tinker/fftw/rdft/problem2.c tinker/fftw/rdft/rank-geq2-rdft2.c tinker/fftw/rdft/rank-geq2.c tinker/fftw/rdft/rank0-rdft2.c tinker/fftw/rdft/rank0.c tinker/fftw/rdft/rdft-dht.c tinker/fftw/rdft/rdft.h tinker/fftw/rdft/rdft2-inplace-strides.c tinker/fftw/rdft/rdft2-rdft.c tinker/fftw/rdft/rdft2-strides.c tinker/fftw/rdft/rdft2-tensor-max-index.c tinker/fftw/rdft/scalar/ tinker/fftw/rdft/simd/ tinker/fftw/rdft/solve.c tinker/fftw/rdft/solve2.c tinker/fftw/rdft/vrank-geq1-rdft2.c tinker/fftw/rdft/vrank-geq1.c tinker/fftw/rdft/vrank3-transpose.c tinker/fftw/rdft/simd/altivec/ tinker/fftw/rdft/simd/avx/ tinker/fftw/rdft/simd/codlist.mk tinker/fftw/rdft/simd/common/ tinker/fftw/rdft/simd/hc2cbv.h tinker/fftw/rdft/simd/hc2cfv.h tinker/fftw/rdft/simd/Makefile.am tinker/fftw/rdft/simd/Makefile.in tinker/fftw/rdft/simd/neon/ tinker/fftw/rdft/simd/simd.mk tinker/fftw/rdft/simd/sse2/ tinker/fftw/rdft/simd/sse2/codlist.c tinker/fftw/rdft/simd/sse2/genus.c tinker/fftw/rdft/simd/sse2/hc2cbdftv_10.c tinker/fftw/rdft/simd/sse2/hc2cbdftv_12.c tinker/fftw/rdft/simd/sse2/hc2cbdftv_16.c 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tinker/fftw/dft/simd/altivec/t1fuv_3.c tinker/fftw/dft/simd/altivec/t1fuv_4.c tinker/fftw/dft/simd/altivec/t1fuv_5.c tinker/fftw/dft/simd/altivec/t1fuv_6.c tinker/fftw/dft/simd/altivec/t1fuv_7.c tinker/fftw/dft/simd/altivec/t1fuv_8.c tinker/fftw/dft/simd/altivec/t1fuv_9.c tinker/fftw/dft/simd/altivec/t1fv_10.c tinker/fftw/dft/simd/altivec/t1fv_12.c tinker/fftw/dft/simd/altivec/t1fv_15.c tinker/fftw/dft/simd/altivec/t1fv_16.c tinker/fftw/dft/simd/altivec/t1fv_2.c tinker/fftw/dft/simd/altivec/t1fv_20.c tinker/fftw/dft/simd/altivec/t1fv_25.c tinker/fftw/dft/simd/altivec/t1fv_3.c tinker/fftw/dft/simd/altivec/t1fv_32.c tinker/fftw/dft/simd/altivec/t1fv_4.c tinker/fftw/dft/simd/altivec/t1fv_5.c tinker/fftw/dft/simd/altivec/t1fv_6.c tinker/fftw/dft/simd/altivec/t1fv_64.c tinker/fftw/dft/simd/altivec/t1fv_7.c tinker/fftw/dft/simd/altivec/t1fv_8.c tinker/fftw/dft/simd/altivec/t1fv_9.c tinker/fftw/dft/simd/altivec/t1sv_16.c tinker/fftw/dft/simd/altivec/t1sv_2.c tinker/fftw/dft/simd/altivec/t1sv_32.c tinker/fftw/dft/simd/altivec/t1sv_4.c tinker/fftw/dft/simd/altivec/t1sv_8.c tinker/fftw/dft/simd/altivec/t2bv_10.c tinker/fftw/dft/simd/altivec/t2bv_16.c tinker/fftw/dft/simd/altivec/t2bv_2.c tinker/fftw/dft/simd/altivec/t2bv_20.c tinker/fftw/dft/simd/altivec/t2bv_25.c tinker/fftw/dft/simd/altivec/t2bv_32.c tinker/fftw/dft/simd/altivec/t2bv_4.c tinker/fftw/dft/simd/altivec/t2bv_5.c tinker/fftw/dft/simd/altivec/t2bv_64.c tinker/fftw/dft/simd/altivec/t2bv_8.c tinker/fftw/dft/simd/altivec/t2fv_10.c tinker/fftw/dft/simd/altivec/t2fv_16.c tinker/fftw/dft/simd/altivec/t2fv_2.c tinker/fftw/dft/simd/altivec/t2fv_20.c tinker/fftw/dft/simd/altivec/t2fv_25.c tinker/fftw/dft/simd/altivec/t2fv_32.c tinker/fftw/dft/simd/altivec/t2fv_4.c tinker/fftw/dft/simd/altivec/t2fv_5.c tinker/fftw/dft/simd/altivec/t2fv_64.c tinker/fftw/dft/simd/altivec/t2fv_8.c tinker/fftw/dft/simd/altivec/t2sv_16.c tinker/fftw/dft/simd/altivec/t2sv_32.c tinker/fftw/dft/simd/altivec/t2sv_4.c tinker/fftw/dft/simd/altivec/t2sv_8.c tinker/fftw/dft/simd/altivec/t3bv_10.c tinker/fftw/dft/simd/altivec/t3bv_16.c tinker/fftw/dft/simd/altivec/t3bv_20.c tinker/fftw/dft/simd/altivec/t3bv_25.c tinker/fftw/dft/simd/altivec/t3bv_32.c tinker/fftw/dft/simd/altivec/t3bv_4.c tinker/fftw/dft/simd/altivec/t3bv_5.c tinker/fftw/dft/simd/altivec/t3bv_8.c tinker/fftw/dft/simd/altivec/t3fv_10.c tinker/fftw/dft/simd/altivec/t3fv_16.c tinker/fftw/dft/simd/altivec/t3fv_20.c tinker/fftw/dft/simd/altivec/t3fv_25.c tinker/fftw/dft/simd/altivec/t3fv_32.c tinker/fftw/dft/simd/altivec/t3fv_4.c tinker/fftw/dft/simd/altivec/t3fv_5.c tinker/fftw/dft/simd/altivec/t3fv_8.c tinker/fftw/dft/scalar/codelets/ tinker/fftw/dft/scalar/f.h tinker/fftw/dft/scalar/Makefile.am tinker/fftw/dft/scalar/Makefile.in tinker/fftw/dft/scalar/n.c tinker/fftw/dft/scalar/n.h tinker/fftw/dft/scalar/q.h tinker/fftw/dft/scalar/t.c tinker/fftw/dft/scalar/t.h tinker/fftw/dft/scalar/codelets/codlist.c tinker/fftw/dft/scalar/codelets/Makefile.am tinker/fftw/dft/scalar/codelets/Makefile.in tinker/fftw/dft/scalar/codelets/n1_10.c tinker/fftw/dft/scalar/codelets/n1_11.c tinker/fftw/dft/scalar/codelets/n1_12.c tinker/fftw/dft/scalar/codelets/n1_13.c tinker/fftw/dft/scalar/codelets/n1_14.c tinker/fftw/dft/scalar/codelets/n1_15.c tinker/fftw/dft/scalar/codelets/n1_16.c tinker/fftw/dft/scalar/codelets/n1_2.c tinker/fftw/dft/scalar/codelets/n1_20.c tinker/fftw/dft/scalar/codelets/n1_25.c tinker/fftw/dft/scalar/codelets/n1_3.c tinker/fftw/dft/scalar/codelets/n1_32.c tinker/fftw/dft/scalar/codelets/n1_4.c tinker/fftw/dft/scalar/codelets/n1_5.c tinker/fftw/dft/scalar/codelets/n1_6.c tinker/fftw/dft/scalar/codelets/n1_64.c tinker/fftw/dft/scalar/codelets/n1_7.c tinker/fftw/dft/scalar/codelets/n1_8.c tinker/fftw/dft/scalar/codelets/n1_9.c tinker/fftw/dft/scalar/codelets/q1_2.c tinker/fftw/dft/scalar/codelets/q1_3.c tinker/fftw/dft/scalar/codelets/q1_4.c tinker/fftw/dft/scalar/codelets/q1_5.c tinker/fftw/dft/scalar/codelets/q1_6.c tinker/fftw/dft/scalar/codelets/q1_8.c tinker/fftw/dft/scalar/codelets/t1_10.c tinker/fftw/dft/scalar/codelets/t1_12.c tinker/fftw/dft/scalar/codelets/t1_15.c tinker/fftw/dft/scalar/codelets/t1_16.c tinker/fftw/dft/scalar/codelets/t1_2.c tinker/fftw/dft/scalar/codelets/t1_20.c tinker/fftw/dft/scalar/codelets/t1_25.c tinker/fftw/dft/scalar/codelets/t1_3.c tinker/fftw/dft/scalar/codelets/t1_32.c tinker/fftw/dft/scalar/codelets/t1_4.c tinker/fftw/dft/scalar/codelets/t1_5.c tinker/fftw/dft/scalar/codelets/t1_6.c tinker/fftw/dft/scalar/codelets/t1_64.c tinker/fftw/dft/scalar/codelets/t1_7.c tinker/fftw/dft/scalar/codelets/t1_8.c tinker/fftw/dft/scalar/codelets/t1_9.c tinker/fftw/dft/scalar/codelets/t2_10.c tinker/fftw/dft/scalar/codelets/t2_16.c tinker/fftw/dft/scalar/codelets/t2_20.c tinker/fftw/dft/scalar/codelets/t2_25.c tinker/fftw/dft/scalar/codelets/t2_32.c tinker/fftw/dft/scalar/codelets/t2_4.c tinker/fftw/dft/scalar/codelets/t2_5.c tinker/fftw/dft/scalar/codelets/t2_64.c tinker/fftw/dft/scalar/codelets/t2_8.c tinker/fftw/api/api.h tinker/fftw/api/apiplan.c tinker/fftw/api/configure.c tinker/fftw/api/execute-dft-c2r.c tinker/fftw/api/execute-dft-r2c.c tinker/fftw/api/execute-dft.c tinker/fftw/api/execute-r2r.c tinker/fftw/api/execute-split-dft-c2r.c tinker/fftw/api/execute-split-dft-r2c.c tinker/fftw/api/execute-split-dft.c tinker/fftw/api/execute.c tinker/fftw/api/export-wisdom-to-file.c tinker/fftw/api/export-wisdom-to-string.c tinker/fftw/api/export-wisdom.c tinker/fftw/api/f03api.sh tinker/fftw/api/f77api.c tinker/fftw/api/f77funcs.h tinker/fftw/api/fftw3.f tinker/fftw/api/fftw3.f03.in tinker/fftw/api/fftw3.h tinker/fftw/api/fftw3l.f03 tinker/fftw/api/fftw3q.f03 tinker/fftw/api/flops.c tinker/fftw/api/forget-wisdom.c tinker/fftw/api/genf03.pl tinker/fftw/api/guru.h tinker/fftw/api/guru64.h tinker/fftw/api/import-system-wisdom.c tinker/fftw/api/import-wisdom-from-file.c tinker/fftw/api/import-wisdom-from-string.c tinker/fftw/api/import-wisdom.c tinker/fftw/api/Makefile.am tinker/fftw/api/Makefile.in tinker/fftw/api/malloc.c tinker/fftw/api/map-r2r-kind.c tinker/fftw/api/mapflags.c tinker/fftw/api/mkprinter-file.c tinker/fftw/api/mktensor-iodims.c tinker/fftw/api/mktensor-iodims.h tinker/fftw/api/mktensor-iodims64.c tinker/fftw/api/mktensor-rowmajor.c tinker/fftw/api/plan-dft-1d.c tinker/fftw/api/plan-dft-2d.c tinker/fftw/api/plan-dft-3d.c tinker/fftw/api/plan-dft-c2r-1d.c tinker/fftw/api/plan-dft-c2r-2d.c tinker/fftw/api/plan-dft-c2r-3d.c tinker/fftw/api/plan-dft-c2r.c tinker/fftw/api/plan-dft-r2c-1d.c tinker/fftw/api/plan-dft-r2c-2d.c tinker/fftw/api/plan-dft-r2c-3d.c tinker/fftw/api/plan-dft-r2c.c tinker/fftw/api/plan-dft.c tinker/fftw/api/plan-guru-dft-c2r.c tinker/fftw/api/plan-guru-dft-c2r.h tinker/fftw/api/plan-guru-dft-r2c.c tinker/fftw/api/plan-guru-dft-r2c.h tinker/fftw/api/plan-guru-dft.c tinker/fftw/api/plan-guru-dft.h tinker/fftw/api/plan-guru-r2r.c tinker/fftw/api/plan-guru-r2r.h tinker/fftw/api/plan-guru-split-dft-c2r.c tinker/fftw/api/plan-guru-split-dft-c2r.h tinker/fftw/api/plan-guru-split-dft-r2c.c tinker/fftw/api/plan-guru-split-dft-r2c.h tinker/fftw/api/plan-guru-split-dft.c tinker/fftw/api/plan-guru-split-dft.h tinker/fftw/api/plan-guru64-dft-c2r.c tinker/fftw/api/plan-guru64-dft-r2c.c tinker/fftw/api/plan-guru64-dft.c tinker/fftw/api/plan-guru64-r2r.c tinker/fftw/api/plan-guru64-split-dft-c2r.c tinker/fftw/api/plan-guru64-split-dft-r2c.c tinker/fftw/api/plan-guru64-split-dft.c tinker/fftw/api/plan-many-dft-c2r.c tinker/fftw/api/plan-many-dft-r2c.c tinker/fftw/api/plan-many-dft.c tinker/fftw/api/plan-many-r2r.c tinker/fftw/api/plan-r2r-1d.c tinker/fftw/api/plan-r2r-2d.c tinker/fftw/api/plan-r2r-3d.c tinker/fftw/api/plan-r2r.c tinker/fftw/api/print-plan.c tinker/fftw/api/rdft2-pad.c tinker/fftw/api/the-planner.c tinker/fftw/api/version.c tinker/fftw/api/x77.h tinker/example/0README tinker/example/alatet.int tinker/example/alatet.key tinker/example/alatet.log tinker/example/alatet.seq tinker/example/alatet.xyz tinker/example/alkane.key tinker/example/alkane.xyz tinker/example/ammonia.key tinker/example/ammonia.xyz tinker/example/amoeba.key tinker/example/amoeba.xyz tinker/example/arach.int tinker/example/arach.key tinker/example/arach.xyz tinker/example/azulene.int tinker/example/azulene.key tinker/example/azulene.xyz tinker/example/bdna.int tinker/example/bdna.key tinker/example/bdna.make tinker/example/bdna.pdb tinker/example/bdna.seq tinker/example/bdna.xyz tinker/example/bearing.key tinker/example/bearing.xyz tinker/example/bearing2.key tinker/example/benzamidine.key tinker/example/benzamidine.xyz tinker/example/benzbox.key tinker/example/benzbox.xyz tinker/example/benzene.int tinker/example/benzene.key tinker/example/benzene.xyz tinker/example/book.key tinker/example/book.xyz tinker/example/bowl.int tinker/example/bowl.key tinker/example/bowl.xyz tinker/example/bowl2.key tinker/example/bowl2.xyz tinker/example/bowl3.key tinker/example/bowl3.xyz tinker/example/bucky.int tinker/example/bucky.key tinker/example/bucky.xyz tinker/example/butane.int tinker/example/butane.key tinker/example/butane.xyz tinker/example/butane2.int tinker/example/butane2.key tinker/example/butane2.xyz tinker/example/butanes.dyn tinker/example/butanes.key tinker/example/butanes.xyz tinker/example/butanex.key tinker/example/butanex.xyz tinker/example/butopls.int tinker/example/butopls.key tinker/example/butopls.xyz tinker/example/butopls2.int tinker/example/butopls2.key tinker/example/butopls2.xyz tinker/example/c5.int tinker/example/c5.key tinker/example/c5.seq tinker/example/c5.xyz tinker/example/c7a.int tinker/example/c7a.key tinker/example/c7a.seq tinker/example/c7a.xyz tinker/example/c7e.int tinker/example/c7e.key tinker/example/c7e.seq tinker/example/c7e.xyz tinker/example/cage.key tinker/example/cage.xyz tinker/example/calmodulin.key tinker/example/calmodulin.pdb tinker/example/calmodulin.seq tinker/example/calmodulin.xyz tinker/example/cawater.key tinker/example/cawater.xyz tinker/example/cln025.key tinker/example/cln025.make tinker/example/cln025.pdb tinker/example/cln025.seq tinker/example/cln025.xyz tinker/example/copper.key tinker/example/copper.xyz tinker/example/cpentene.key tinker/example/cpentene.xyz tinker/example/crambin.dyn tinker/example/crambin.key tinker/example/crambin.pdb tinker/example/crambin.seq tinker/example/crambin.xyz tinker/example/crambinx.key tinker/example/crambinx.ray tinker/example/crambinx.xyz tinker/example/crown.int tinker/example/crown.key tinker/example/crown.xyz tinker/example/cychept.int tinker/example/cychept.key tinker/example/cychept.xyz tinker/example/cyclo.int tinker/example/cyclo.key tinker/example/cyclo.xyz tinker/example/cyclo2.int tinker/example/cyclo2.key tinker/example/cyclo2.xyz tinker/example/cycprop.key tinker/example/cycprop.xyz tinker/example/dang.key tinker/example/dang.xyz tinker/example/deltorphin.int tinker/example/deltorphin.key tinker/example/deltorphin.make tinker/example/deltorphin.seq tinker/example/deltorphin.xyz tinker/example/dhfr.key tinker/example/dhfr.pdb tinker/example/dhfr.seq tinker/example/dhfr.xyz tinker/example/dhfr2.key tinker/example/dhfr2.seq tinker/example/dhfr2.xyz tinker/example/diamond.key tinker/example/diamond.xyz tinker/example/diene.int tinker/example/diene.key tinker/example/diene.xyz tinker/example/dimethane.key tinker/example/dimethane.xyz tinker/example/dmp.key tinker/example/dmp.xyz tinker/example/enkephalin.int tinker/example/enkephalin.key tinker/example/enkephalin.make tinker/example/enkephalin.seq tinker/example/enkephalin.xyz tinker/example/ermer.int tinker/example/ermer.key tinker/example/ermer.xyz tinker/example/ester.key tinker/example/ester.xyz tinker/example/ethane.int tinker/example/ethane.key tinker/example/ethane.xyz tinker/example/ethanol.int tinker/example/ethanol.key tinker/example/ethanol.xyz tinker/example/ether.key tinker/example/ether.xyz tinker/example/etherbox.dyn tinker/example/etherbox.key tinker/example/etherbox.xyz tinker/example/ethylene.int tinker/example/ethylene.key tinker/example/ethylene.xyz tinker/example/flane.int tinker/example/flane.key tinker/example/flane.xyz tinker/example/form.key tinker/example/form.xyz tinker/example/formbig.key tinker/example/formbig.xyz tinker/example/formbox.dyn tinker/example/formbox.key tinker/example/formbox.xyz tinker/example/formopls.dyn tinker/example/formopls.key tinker/example/formopls.xyz tinker/example/furan.int tinker/example/furan.key tinker/example/furan.xyz tinker/example/glucose.key tinker/example/glucose.xyz tinker/example/glycerol.dyn tinker/example/glycerol.key tinker/example/glycerol.xyz tinker/example/graphite.key tinker/example/graphite.xyz tinker/example/helix.dyn tinker/example/helix.key tinker/example/helix.xyz tinker/example/heme.key tinker/example/heme.xyz tinker/example/hexane.int tinker/example/hexane.key tinker/example/hexane.xyz tinker/example/hexanes.dyn tinker/example/hexanes.key tinker/example/hexanes.xyz tinker/example/iamoeba.key tinker/example/iamoeba.xyz tinker/example/imidazole.int tinker/example/imidazole.key tinker/example/imidazole.xyz tinker/example/imine.int tinker/example/imine.key tinker/example/imine.xyz tinker/example/indole.key tinker/example/indole.xyz tinker/example/lactam.key tinker/example/lactam.xyz tinker/example/lipid.key tinker/example/lipid.xyz tinker/example/lj38.key tinker/example/lj38.xyz tinker/example/melittin.key tinker/example/melittin.pdb tinker/example/melittin.seq tinker/example/melittin.xyz tinker/example/membrane.key tinker/example/membrane.xyz tinker/example/meohbox.key tinker/example/meohbox.xyz tinker/example/methane.int tinker/example/methane.key tinker/example/methane.xyz tinker/example/methanol.key tinker/example/methanol.xyz tinker/example/mgwater.key tinker/example/mgwater.xyz tinker/example/mm3.key tinker/example/mm3.xyz tinker/example/nacl.key tinker/example/nacl.xyz tinker/example/nada.key tinker/example/nada.xyz tinker/example/naphthalene.int tinker/example/naphthalene.key tinker/example/naphthalene.xyz tinker/example/naphthax.frac tinker/example/naphthax.key tinker/example/naphthax.xyz tinker/example/nitrile.key tinker/example/nitrile.xyz tinker/example/nitrogen.dyn tinker/example/nitrogen.key tinker/example/nitrogen.xyz tinker/example/nma.int tinker/example/nma.key tinker/example/nma.xyz tinker/example/nmabox.dyn tinker/example/nmabox.key tinker/example/nmabox.xyz tinker/example/nmf.key tinker/example/nmf.xyz tinker/example/nstilbene.int tinker/example/nstilbene.key tinker/example/nstilbene.xyz tinker/example/octane.int tinker/example/octane.key tinker/example/octane.xyz tinker/example/octane2.int tinker/example/octane2.key tinker/example/octane2.xyz tinker/example/octene.dyn tinker/example/octene.key tinker/example/octene.xyz tinker/example/palmitate.int tinker/example/palmitate.key tinker/example/palmitate.xyz tinker/example/pentane.frac tinker/example/pentane.key tinker/example/pentane.xyz tinker/example/peptide.int tinker/example/peptide.key tinker/example/peptide.make tinker/example/peptide.pdb tinker/example/peptide.seq tinker/example/peptide.xyz tinker/example/phenanth.key tinker/example/phenanth.xyz tinker/example/photo.key tinker/example/photo.pdb tinker/example/photo.seq tinker/example/photo.xyz tinker/example/pol3.key tinker/example/pol3.xyz tinker/example/polyala.key tinker/example/polyala.xyz tinker/example/prism.key tinker/example/prism.xyz tinker/example/propane.key tinker/example/propane.ray tinker/example/propane.xyz tinker/example/propellane.int tinker/example/propellane.key tinker/example/propellane.xyz tinker/example/propyne.key tinker/example/propyne.xyz tinker/example/pyridine.int tinker/example/pyridine.key tinker/example/pyridine.xyz tinker/example/pyrrole.int tinker/example/pyrrole.key tinker/example/pyrrole.xyz tinker/example/retinoic.key tinker/example/retinoic.xyz tinker/example/ring.key tinker/example/ring.xyz tinker/example/skunk.key tinker/example/skunk.xyz tinker/example/spc.key tinker/example/spc.xyz tinker/example/sterol.key tinker/example/sterol.xyz tinker/example/styrene.int tinker/example/styrene.key tinker/example/styrene.xyz tinker/example/terphenyl.key tinker/example/terphenyl.xyz tinker/example/tfe.key tinker/example/tfe.xyz tinker/example/thiadiene.int tinker/example/thiadiene.key tinker/example/thiadiene.xyz tinker/example/thiophene.int tinker/example/thiophene.key tinker/example/thiophene.xyz tinker/example/thr.int tinker/example/thr.key tinker/example/thr.xyz tinker/example/tip3f.key tinker/example/tip3f.xyz tinker/example/tip3p.key tinker/example/tip3p.xyz tinker/example/tip4f.key tinker/example/tip4f.xyz tinker/example/tip4p.key tinker/example/tip4p.xyz tinker/example/tip5p.key tinker/example/tip5p.xyz tinker/example/trpcage.key tinker/example/trpcage.pdb tinker/example/trpcage.seq tinker/example/trpcage.xyz tinker/example/ubiquitin.key tinker/example/ubiquitin.pdb tinker/example/ubiquitin.seq tinker/example/ubiquitin.xyz tinker/example/ubiquitin2.key tinker/example/ubiquitin2.seq tinker/example/ubiquitin2.xyz tinker/example/urea.frac tinker/example/urea.key tinker/example/urea.xyz tinker/example/water.int tinker/example/water.key tinker/example/water.xyz tinker/example/waterball.key tinker/example/waterball.xyz tinker/example/waterbig.key tinker/example/waterbig.xyz tinker/example/waterbox.dyn tinker/example/waterbox.key tinker/example/waterbox.xyz tinker/example/waterdot.dyn tinker/example/waterdot.key tinker/example/waterdot.xyz tinker/example/waterglobe.key tinker/example/waterglobe.xyz tinker/example/waterhuge.key tinker/example/waterhuge.xyz tinker/example/waterslab.dyn tinker/example/waterslab.key tinker/example/waterslab.xyz tinker/example/watersmall.dyn tinker/example/watersmall.key tinker/example/watersmall.xyz tinker/example/watertiny.dyn tinker/example/watertiny.key tinker/example/watertiny.xyz tinker/example/white.int tinker/example/white.key tinker/example/white.xyz tinker/doc/0README tinker/doc/ffe-guide.pdf tinker/doc/guide.pdf tinker/doc/license.pdf tinker/doc/license.txt tinker/doc/summary.pdf tinker/doc/summary.txt tinker/configure/0README tinker/configure/configure.ac tinker/configure/Makefile.am tinker/bench/0README tinker/bench/bench1.key tinker/bench/bench1.run tinker/bench/bench1.xyz tinker/bench/bench2.key tinker/bench/bench2.run tinker/bench/bench2.xyz tinker/bench/bench3.key tinker/bench/bench3.run tinker/bench/bench3.xyz tinker/bench/bench4.dyn0 tinker/bench/bench4.key tinker/bench/bench4.log tinker/bench/bench4.run tinker/bench/bench4.xyz tinker/bench/bench5.dyn0 tinker/bench/bench5.key tinker/bench/bench5.log tinker/bench/bench5.run tinker/bench/bench5.xyz tinker/bench/bench6.key tinker/bench/bench6.log tinker/bench/bench6.run tinker/bench/bench6.xyz tinker/bench/bench7.key tinker/bench/bench7.log tinker/bench/bench7.run tinker/bench/bench7.xyz tinker/bench/results-2.3 tinker/bench/results-2.4 tinker/bench/results-2.9 tinker/bench/results-3.1 tinker/bench/results-3.2 tinker/bench/results-3.4 tinker/bench/results-3.5 tinker/bench/results-3.7 tinker/bench/results-3.8 tinker/bench/results-3.9 tinker/bench/results-4.0 tinker/bench/results-4.1 tinker/bench/results-4.2 tinker/bench/results-4.3 tinker/bench/results-5.0 tinker/bench/results-5.1 tinker/bench/results-6.0 tinker/bench/results-6.2 sudo -u fink-bld [ENV] sh -c /tmp/fink.j05LP [ -r /sw/fink/dists/stable/main/finkinfo/sci/tinker.patch ] sudo -u fink-bld [ENV] sh -c /tmp/fink.jB_dz /tmp/fink.YAhi5 # system-wide environment settings for zsh(1) if [ -x /usr/libexec/path_helper ]; then eval `/usr/libexec/path_helper -s` fi #!/bin/zsh -efv patch -p1 < /sw/fink/dists/stable/main/finkinfo/sci/tinker.patch patching file source/initial.f perl -pi -e 's|gfortran -c -O3|gfortran-fsf-4.8 -c -O3 -fno-align-commons -fopenmp|g' macosx/**/*.make perl -pi -e 's|gfortran |gfortran-fsf-4.8 -fopenmp |g' macosx/**/link*.make perl -pi -e 's|libtinker.a|libtinker.a -L/sw/lib -lfftw3 -lfftw3_omp -L/sw/lib/gcc4.8/lib -lgomp|g' macosx/**/link*.make sudo -u fink-bld [ENV] sh -c /tmp/fink.4h6dz /tmp/fink.Msh_0 #!/bin/bash -ev cd source ls -1 0README action.i active.f alchemy.f align.i analysis.f analyz.i analyze.f angang.i angle.i angles.f angpot.i anneal.f archive.f argue.i ascii.i atmlst.i atmtyp.i atoms.i attach.f bar.f basefile.f bath.i beeman.f bicubic.f bitor.i bitors.f bndpot.i bond.i bonds.f border.i born.f bound.i bounds.f boxes.i bussi.f calendar.f cell.i center.f charge.i chgpot.i chkpole.f chkring.f chkxyz.f cholesky.f chrono.i chunks.i clock.f cluster.f column.f command.f connect.f connolly.f control.f correlate.f couple.i crystal.f cspline.f cutoff.i cutoffs.f deflate.f delete.f deriv.i diagq.f diffeq.f diffuse.f dipole.i disgeo.i distgeom.f dma.i document.f domega.i dynamic.f eangang.f eangang1.f eangang2.f eangang3.f eangle.f eangle1.f eangle2.f eangle3.f ebond.f ebond1.f ebond2.f ebond3.f ebuck.f ebuck1.f ebuck2.f ebuck3.f echarge.f echarge1.f echarge2.f echarge3.f echgdpl.f echgdpl1.f echgdpl2.f echgdpl3.f edipole.f edipole1.f edipole2.f edipole3.f egauss.f egauss1.f egauss2.f egauss3.f egeom.f egeom1.f egeom2.f egeom3.f ehal.f ehal1.f ehal2.f ehal3.f eimprop.f eimprop1.f eimprop2.f eimprop3.f eimptor.f eimptor1.f eimptor2.f eimptor3.f elj.f elj1.f elj2.f elj3.f embed.f emetal.f emetal1.f emetal2.f emetal3.f emm3hb.f emm3hb1.f emm3hb2.f emm3hb3.f empole.f empole1.f empole2.f empole3.f energi.i energy.f eopbend.f eopbend1.f eopbend2.f eopbend3.f eopdist.f eopdist1.f eopdist2.f eopdist3.f epitors.f epitors1.f epitors2.f epitors3.f erf.f erxnfld.f erxnfld1.f erxnfld2.f erxnfld3.f esolv.f esolv1.f esolv2.f esolv3.f estrbnd.f estrbnd1.f estrbnd2.f estrbnd3.f estrtor.f estrtor1.f estrtor2.f estrtor3.f etors.f etors1.f etors2.f etors3.f etortor.f etortor1.f etortor2.f etortor3.f eurey.f eurey1.f eurey2.f eurey3.f evcorr.f ewald.i extra.f extra1.f extra2.f extra3.f faces.i fatal.f fft.i fft3d.f fftpack.f field.f fields.i files.i final.f flatten.f fracs.i freeunit.f freeze.i gda.f geometry.f getint.f getkey.f getmol.f getmol2.f getnumb.f getpdb.f getprm.f getref.f getstring.f gettext.f getword.f getxyz.f ghmcstep.f gkstuf.i gradient.f gradrgd.f gradrot.f group.i groups.f grpline.f gyrate.f hescut.i hessian.f hessn.i hessrgd.f hessrot.f hpmf.i hybrid.f image.f impose.f improp.i imptor.i induce.f inertia.f inform.i initatom.f initial.f initprm.f initres.f initrot.f insert.f intedit.f inter.i intxyz.f invbeta.f invert.f iounit.i jacobi.f kanang.i kangang.f kangle.f kangs.i katom.f katoms.i kbond.f kbonds.i kcharge.f kchrge.i kdipol.i kdipole.f kewald.f kextra.f keys.i kgeom.f kgeoms.i khbond.i kimprop.f kimptor.f kinetic.f kiprop.i kitors.i kmetal.f kmpole.f kmulti.i kopbend.f kopbnd.i kopdist.f kopdst.i korbit.f korbs.i kpitor.i kpitors.f kpolar.f kpolr.i ksolv.f kstbnd.i kstrbnd.f kstrtor.f ksttor.i ktors.f ktorsn.i ktortor.f ktrtor.i kurey.f kurybr.i kvdw.f kvdwpr.i kvdws.i lattice.f lbfgs.f light.i lights.f linmin.i makeint.f makeref.f makexyz.f math.i maxwell.f mdinit.f mdrest.f mdsave.f mdstat.f mdstuf.i mechanic.f merck.i merge.f minima.i minimize.f minirot.f minrigid.f molcul.i moldyn.i molecule.f molxyz.f moment.i moments.f monte.f mplpot.i mpole.i mutant.i mutate.f nblist.f neigh.i newton.f newtrot.f nextarg.f nexttext.f nose.f npolar.i nspline.f nucleic.f nucleo.i number.f numeral.f numgrad.f ocvm.f omega.i opbend.i opdist.i openend.f openmp.i optimize.f optirot.f optrigid.f optsave.f orbital.f orbits.i orient.f orthog.f output.i overlap.f params.i path.f paths.i pbstuf.i pdb.i pdbxyz.f phipsi.i picalc.f piorbs.i pistuf.i pitors.i pme.i pmestuff.f pmpb.c pmpb.f polar.i polarize.f poledit.f polgrp.i polpot.i polymer.f potent.i potential.f potfit.i precis.i precise.f pressure.f prmedit.f prmkey.f promo.f protein.f prtdyn.f prterr.f prtint.f prtmol2.f prtpdb.f prtprm.f prtseq.f prtxyz.f pss.f pssrigid.f pssrot.f ptable.i qmstuf.i quatfit.f radial.f random.f rattle.f readdyn.f readgau.f readint.f readmol.f readmol2.f readpdb.f readprm.f readseq.f readxyz.f refer.i replica.f resdue.i respa.f rgddyn.i rgdstep.f rigid.i ring.i rings.f rmsfit.f rotate.i rotlist.f rotpole.f rxnfld.i rxnpot.i saddle.f scales.i scan.f sdstep.f search.f sequen.i server.c server.f shakeup.f shunt.i sigmoid.f sizes.i sktstuff.f sniffer.f socket.i solute.i sort.f spacefill.f spectrum.f square.f stodyn.i strbnd.i strtor.i suffix.f superpose.f surface.f surfatom.f switch.f sybylxyz.f syntrn.i temper.f testgrad.f testhess.f testpair.f testpol.f testrot.f timer.f timerot.f titles.i tncg.f torphase.f torpot.i torque.f tors.i torsfit.f torsions.f tortor.i tree.i trimtext.f unitcell.f units.i uprior.i urey.i urypot.i usage.i usolve.i valence.f valfit.i vdw.i vdwpot.i verlet.f version.f vibbig.f vibrate.f vibrot.f vibs.i virial.i volume.f warp.i xtalfit.f xtalmin.f xtals.i xyzatm.f xyzedit.f xyzint.f xyzpdb.f xyzsybyl.f zatom.f zclose.i zcoord.i : : "This will take a few minutes to compile everything ..." : ../macosx/gfortran/compile.make pmestuff.f:54.25: call bsplgen (w,thetai1(1,1,i)) 1 Warning: Element of assumed-shaped or pointer array passed to array dummy argument 'thetai' at (1) pmestuff.f:60.25: call bsplgen (w,thetai2(1,1,i)) 1 Warning: Element of assumed-shaped or pointer array passed to array dummy argument 'thetai' at (1) pmestuff.f:66.25: call bsplgen (w,thetai3(1,1,i)) 1 Warning: Element of assumed-shaped or pointer array passed to array dummy argument 'thetai' at (1) ../macosx/gfortran/library.make a - active.o a - analysis.o a - angles.o a - attach.o a - basefile.o a - beeman.o a - bicubic.o a - bitors.o a - bonds.o a - born.o a - bounds.o a - bussi.o a - calendar.o a - center.o a - chkpole.o a - chkring.o a - chkxyz.o a - cholesky.o a - clock.o a - cluster.o a - column.o a - command.o a - connect.o a - connolly.o a - control.o a - cspline.o a - cutoffs.o a - deflate.o a - delete.o a - diagq.o a - diffeq.o a - eangang.o a - eangang1.o a - eangang2.o a - eangang3.o a - eangle.o a - eangle1.o a - eangle2.o a - eangle3.o a - ebond.o a - ebond1.o a - ebond2.o a - ebond3.o a - ebuck.o a - ebuck1.o a - ebuck2.o a - ebuck3.o a - echarge.o a - echarge1.o a - echarge2.o a - echarge3.o a - echgdpl.o a - echgdpl1.o a - echgdpl2.o a - echgdpl3.o a - edipole.o a - edipole1.o a - edipole2.o a - edipole3.o a - egauss.o a - egauss1.o a - egauss2.o a - egauss3.o a - egeom.o a - egeom1.o a - egeom2.o a - egeom3.o a - ehal.o a - ehal1.o a - ehal2.o a - ehal3.o a - eimprop.o a - eimprop1.o a - eimprop2.o a - eimprop3.o a - eimptor.o a - eimptor1.o a - eimptor2.o a - eimptor3.o a - elj.o a - elj1.o a - elj2.o a - elj3.o a - embed.o a - emetal.o a - emetal1.o a - emetal2.o a - emetal3.o a - emm3hb.o a - emm3hb1.o a - emm3hb2.o a - emm3hb3.o a - empole.o a - empole1.o a - empole2.o a - empole3.o a - energy.o a - eopbend.o a - eopbend1.o a - eopbend2.o a - eopbend3.o a - eopdist.o a - eopdist1.o a - eopdist2.o a - eopdist3.o a - epitors.o a - epitors1.o a - epitors2.o a - epitors3.o a - erf.o a - erxnfld.o a - erxnfld1.o a - erxnfld2.o a - erxnfld3.o a - esolv.o a - esolv1.o a - esolv2.o a - esolv3.o a - estrbnd.o a - estrbnd1.o a - estrbnd2.o a - estrbnd3.o a - estrtor.o a - estrtor1.o a - estrtor2.o a - estrtor3.o a - etors.o a - etors1.o a - etors2.o a - etors3.o a - etortor.o a - etortor1.o a - etortor2.o a - etortor3.o a - eurey.o a - eurey1.o a - eurey2.o a - eurey3.o a - evcorr.o a - extra.o a - extra1.o a - extra2.o a - extra3.o a - fatal.o a - fft3d.o a - fftpack.o a - field.o a - final.o a - flatten.o a - freeunit.o a - geometry.o a - getint.o a - getkey.o a - getmol.o a - getmol2.o a - getnumb.o a - getpdb.o a - getprm.o a - getref.o a - getstring.o a - gettext.o a - getword.o a - getxyz.o a - ghmcstep.o a - gradient.o a - gradrgd.o a - gradrot.o a - groups.o a - grpline.o a - gyrate.o a - hessian.o a - hessrgd.o a - hessrot.o a - hybrid.o a - image.o a - impose.o a - induce.o a - inertia.o a - initatom.o a - initial.o a - initprm.o a - initres.o a - initrot.o a - insert.o a - invbeta.o a - invert.o a - jacobi.o a - kangang.o a - kangle.o a - katom.o a - kbond.o a - kcharge.o a - kdipole.o a - kewald.o a - kextra.o a - kgeom.o a - kimprop.o a - kimptor.o a - kinetic.o a - kmetal.o a - kmpole.o a - kopbend.o a - kopdist.o a - korbit.o a - kpitors.o a - kpolar.o a - ksolv.o a - kstrbnd.o a - kstrtor.o a - ktors.o a - ktortor.o a - kurey.o a - kvdw.o a - lattice.o a - lbfgs.o a - lights.o a - makeint.o a - makeref.o a - makexyz.o a - maxwell.o a - mdinit.o a - mdrest.o a - mdsave.o a - mdstat.o a - mechanic.o a - merge.o a - molecule.o a - moments.o a - mutate.o a - nblist.o a - nextarg.o a - nexttext.o a - nose.o a - nspline.o a - number.o a - numeral.o a - numgrad.o a - ocvm.o a - openend.o a - optsave.o a - orbital.o a - orient.o a - orthog.o a - overlap.o a - picalc.o a - pmestuff.o a - pmpb.o a - polymer.o a - precise.o a - pressure.o a - prmkey.o a - promo.o a - prtdyn.o a - prterr.o a - prtint.o a - prtmol2.o a - prtpdb.o a - prtprm.o a - prtseq.o a - prtxyz.o a - quatfit.o a - random.o a - rattle.o a - readdyn.o a - readgau.o a - readint.o a - readmol.o a - readmol2.o a - readpdb.o a - readprm.o a - readseq.o a - readxyz.o a - replica.o a - respa.o a - rgdstep.o a - rings.o a - rmsfit.o a - rotlist.o a - rotpole.o a - sdstep.o a - search.o a - server.o a - shakeup.o a - sigmoid.o a - sktstuff.o a - sort.o a - square.o a - suffix.o a - surface.o a - surfatom.o a - switch.o a - temper.o a - tncg.o a - torphase.o a - torque.o a - torsions.o a - trimtext.o a - unitcell.o a - verlet.o a - version.o a - volume.o a - xyzatm.o a - zatom.o ranlib libtinker.a ../macosx/gfortran/link.make ../macosx/gfortran/linkgui.make mkdir -p ../bin ../macosx/gfortran/rename.make cd .. /bin/rm -rf linux make source unix macosx other windows /bin/rm -rf /sw/build.build/root-tinker-6.2.06-1 /bin/mkdir -p /sw/build.build/root-tinker-6.2.06-1/sw /bin/mkdir -p /sw/build.build/root-tinker-6.2.06-1/DEBIAN /usr/sbin/chown -R fink-bld:fink-bld /sw/build.build/root-tinker-6.2.06-1 sudo -u fink-bld [ENV] sh -c /tmp/fink.RFOdd mkdir -p /sw/build.build/root-tinker-6.2.06-1/sw/share/tinker cp -R * /sw/build.build/root-tinker-6.2.06-1/sw/share/tinker/. mkdir -p /sw/build.build/root-tinker-6.2.06-1/sw/share/doc/tinker cp -R /sw/build.build/root-tinker-6.2.06-1/sw/share/tinker/doc/* /sw/build.build/root-tinker-6.2.06-1/sw/share/doc/tinker/. mkdir -p /sw/build.build/root-tinker-6.2.06-1/sw/etc/profile.d echo "set path = ( \$path /sw/share/tinker/bin )" > /sw/build.build/root-tinker-6.2.06-1/sw/etc/profile.d/tinker.csh echo "PATH=\$PATH:/sw/share/tinker/bin" > /sw/build.build/root-tinker-6.2.06-1/sw/etc/profile.d/tinker.sh echo "export PATH" >> /sw/build.build/root-tinker-6.2.06-1/sw/etc/profile.d/tinker.sh chmod 755 /sw/build.build/root-tinker-6.2.06-1/sw/etc/profile.d/tinker.* sudo -u fink-bld [ENV] sh -c /tmp/fink.UHimH /bin/rm -f /sw/build.build/root-tinker-6.2.06-1/sw/info/dir /sw/build.build/root-tinker-6.2.06-1/sw/info/dir.old /sw/build.build/root-tinker-6.2.06-1/sw/share/info/dir /sw/build.build/root-tinker-6.2.06-1/sw/share/info/dir.old Reverting ownership of install dir to root Writing control file... Writing md5sums file... env LANG=C LC_ALL=C dpkg-deb -b root-tinker-6.2.06-1 /sw/fink/10.9/stable/main/binary-darwin-x86_64/sci dpkg-deb: building package `tinker' in `/sw/fink/10.9/stable/main/binary-darwin-x86_64/sci/tinker_6.2.06-1_darwin-x86_64.deb'. Removing runtime build-lock... Removing build-lock package... /sw/bin/dpkg-lockwait -r fink-buildlock-tinker-6.2.06-1 (Reading database ... 9994 files and directories currently installed.) Removing fink-buildlock-tinker-6.2.06-1 ...