diff options
Diffstat (limited to 'biology/tinker/pkg-plist')
-rw-r--r-- | biology/tinker/pkg-plist | 697 |
1 files changed, 352 insertions, 345 deletions
diff --git a/biology/tinker/pkg-plist b/biology/tinker/pkg-plist index b7d3ffb..f9e728d 100644 --- a/biology/tinker/pkg-plist +++ b/biology/tinker/pkg-plist @@ -24,6 +24,7 @@ bin/optrigid bin/path bin/pdbxyz bin/polarize +bin/prmedit bin/protein bin/pss bin/pssrigid @@ -55,6 +56,7 @@ bin/xyzint bin/xyzpdb bin/xyzsybyl %%PORTDOCS%%%%DOCSDIR%%/README +%%PORTDOCS%%%%DOCSDIR%%/ffe-guide.pdf %%PORTDOCS%%%%DOCSDIR%%/guide.pdf %%PORTDOCS%%%%DOCSDIR%%/guide.txt %%PORTDOCS%%%%DOCSDIR%%/license.pdf @@ -66,6 +68,7 @@ bin/xyzsybyl %%PORTDOCS%%%%DOCSDIR%%/release-3.9 %%PORTDOCS%%%%DOCSDIR%%/release-4.0 %%PORTDOCS%%%%DOCSDIR%%/release-4.1 +%%PORTDOCS%%%%DOCSDIR%%/release-4.2 %%PORTDOCS%%%%DOCSDIR%%/summary.pdf %%PORTDOCS%%%%DOCSDIR%%/summary.txt %%PORTDOCS%%share/examples/tinker/README @@ -115,350 +118,354 @@ bin/xyzsybyl %%PORTDOCS%%share/examples/tinker/salt.key %%PORTDOCS%%share/examples/tinker/salt.log %%PORTDOCS%%share/examples/tinker/salt.run -%%PORTDOCS%%share/tinker/bench/README -%%PORTDOCS%%share/tinker/bench/bench1.key -%%PORTDOCS%%share/tinker/bench/bench1.run -%%PORTDOCS%%share/tinker/bench/bench1.xyz -%%PORTDOCS%%share/tinker/bench/bench2.key -%%PORTDOCS%%share/tinker/bench/bench2.run -%%PORTDOCS%%share/tinker/bench/bench2.xyz -%%PORTDOCS%%share/tinker/bench/bench3.key -%%PORTDOCS%%share/tinker/bench/bench3.run -%%PORTDOCS%%share/tinker/bench/bench3.xyz -%%PORTDOCS%%share/tinker/bench/bench4.dyn0 -%%PORTDOCS%%share/tinker/bench/bench4.key -%%PORTDOCS%%share/tinker/bench/bench4.log -%%PORTDOCS%%share/tinker/bench/bench4.run -%%PORTDOCS%%share/tinker/bench/bench4.xyz -%%PORTDOCS%%share/tinker/bench/bench5.dyn0 -%%PORTDOCS%%share/tinker/bench/bench5.key -%%PORTDOCS%%share/tinker/bench/bench5.log -%%PORTDOCS%%share/tinker/bench/bench5.run -%%PORTDOCS%%share/tinker/bench/bench5.xyz -%%PORTDOCS%%share/tinker/bench/results-2.3 -%%PORTDOCS%%share/tinker/bench/results-2.4 -%%PORTDOCS%%share/tinker/bench/results-2.9 -%%PORTDOCS%%share/tinker/bench/results-3.1 -%%PORTDOCS%%share/tinker/bench/results-3.2 -%%PORTDOCS%%share/tinker/bench/results-3.4 -%%PORTDOCS%%share/tinker/bench/results-3.5 -%%PORTDOCS%%share/tinker/bench/results-3.7 -%%PORTDOCS%%share/tinker/bench/results-3.8 -%%PORTDOCS%%share/tinker/bench/results-3.9 -%%PORTDOCS%%share/tinker/bench/results-4.0 -%%PORTDOCS%%share/tinker/bench/results-4.1 -share/tinker/params/README -share/tinker/params/amber94.prm -share/tinker/params/amber96.prm -share/tinker/params/amber98.prm -share/tinker/params/amber99.prm -share/tinker/params/amoeba.prm -share/tinker/params/charmm19.prm -share/tinker/params/charmm27.prm -share/tinker/params/dudek.prm -share/tinker/params/hoch.prm -share/tinker/params/mm2.prm -share/tinker/params/mm3.prm -share/tinker/params/mm3pro.prm -share/tinker/params/oplsaa.prm -share/tinker/params/oplsaal.prm -share/tinker/params/oplsua.prm -share/tinker/params/smooth.prm -share/tinker/params/smoothaa.prm -share/tinker/params/water.prm -%%WITH_VIEWER%%share/tinker/rasmol/rasmol.hlp -%%PORTDOCS%%share/tinker/test/README -%%PORTDOCS%%share/tinker/test/alkane.key -%%PORTDOCS%%share/tinker/test/alkane.xyz -%%PORTDOCS%%share/tinker/test/amoeba.key -%%PORTDOCS%%share/tinker/test/amoeba.xyz -%%PORTDOCS%%share/tinker/test/arach.int -%%PORTDOCS%%share/tinker/test/arach.key -%%PORTDOCS%%share/tinker/test/arach.xyz -%%PORTDOCS%%share/tinker/test/azulene.int -%%PORTDOCS%%share/tinker/test/azulene.key -%%PORTDOCS%%share/tinker/test/azulene.xyz -%%PORTDOCS%%share/tinker/test/bdna.int -%%PORTDOCS%%share/tinker/test/bdna.key -%%PORTDOCS%%share/tinker/test/bdna.make -%%PORTDOCS%%share/tinker/test/bdna.seq -%%PORTDOCS%%share/tinker/test/bdna.xyz -%%PORTDOCS%%share/tinker/test/bearing.key -%%PORTDOCS%%share/tinker/test/bearing.xyz -%%PORTDOCS%%share/tinker/test/bearing2.key -%%PORTDOCS%%share/tinker/test/bearing2.xyz -%%PORTDOCS%%share/tinker/test/benzene.int -%%PORTDOCS%%share/tinker/test/benzene.key -%%PORTDOCS%%share/tinker/test/benzene.xyz -%%PORTDOCS%%share/tinker/test/bowl.int -%%PORTDOCS%%share/tinker/test/bowl.key -%%PORTDOCS%%share/tinker/test/bowl.xyz -%%PORTDOCS%%share/tinker/test/bowl2.key -%%PORTDOCS%%share/tinker/test/bowl2.xyz -%%PORTDOCS%%share/tinker/test/bowl3.key -%%PORTDOCS%%share/tinker/test/bowl3.xyz -%%PORTDOCS%%share/tinker/test/bucky.int -%%PORTDOCS%%share/tinker/test/bucky.key -%%PORTDOCS%%share/tinker/test/bucky.xyz -%%PORTDOCS%%share/tinker/test/butane.int -%%PORTDOCS%%share/tinker/test/butane.key -%%PORTDOCS%%share/tinker/test/butane.xyz -%%PORTDOCS%%share/tinker/test/butane2.int -%%PORTDOCS%%share/tinker/test/butane2.key -%%PORTDOCS%%share/tinker/test/butane2.xyz -%%PORTDOCS%%share/tinker/test/butanes.dyn -%%PORTDOCS%%share/tinker/test/butanes.key -%%PORTDOCS%%share/tinker/test/butanes.xyz -%%PORTDOCS%%share/tinker/test/butanex.key -%%PORTDOCS%%share/tinker/test/butanex.xyz -%%PORTDOCS%%share/tinker/test/butopls.int -%%PORTDOCS%%share/tinker/test/butopls.key -%%PORTDOCS%%share/tinker/test/butopls.xyz -%%PORTDOCS%%share/tinker/test/butopls2.int -%%PORTDOCS%%share/tinker/test/butopls2.key -%%PORTDOCS%%share/tinker/test/butopls2.xyz -%%PORTDOCS%%share/tinker/test/c5.key -%%PORTDOCS%%share/tinker/test/c5.seq -%%PORTDOCS%%share/tinker/test/c5.xyz -%%PORTDOCS%%share/tinker/test/c7a.key -%%PORTDOCS%%share/tinker/test/c7a.seq -%%PORTDOCS%%share/tinker/test/c7a.xyz -%%PORTDOCS%%share/tinker/test/c7e.key -%%PORTDOCS%%share/tinker/test/c7e.seq -%%PORTDOCS%%share/tinker/test/c7e.xyz -%%PORTDOCS%%share/tinker/test/calmodulin.key -%%PORTDOCS%%share/tinker/test/calmodulin.pdb -%%PORTDOCS%%share/tinker/test/calmodulin.seq -%%PORTDOCS%%share/tinker/test/calmodulin.xyz -%%PORTDOCS%%share/tinker/test/copper.key -%%PORTDOCS%%share/tinker/test/copper.xyz -%%PORTDOCS%%share/tinker/test/cpentene.key -%%PORTDOCS%%share/tinker/test/cpentene.xyz -%%PORTDOCS%%share/tinker/test/crambin.key -%%PORTDOCS%%share/tinker/test/crambin.pdb -%%PORTDOCS%%share/tinker/test/crambin.seq -%%PORTDOCS%%share/tinker/test/crambin.xyz -%%PORTDOCS%%share/tinker/test/crambinx.key -%%PORTDOCS%%share/tinker/test/crambinx.ray -%%PORTDOCS%%share/tinker/test/crambinx.xyz -%%PORTDOCS%%share/tinker/test/crown.int -%%PORTDOCS%%share/tinker/test/crown.key -%%PORTDOCS%%share/tinker/test/crown.xyz -%%PORTDOCS%%share/tinker/test/cychept.int -%%PORTDOCS%%share/tinker/test/cychept.key -%%PORTDOCS%%share/tinker/test/cychept.xyz -%%PORTDOCS%%share/tinker/test/cyclo.int -%%PORTDOCS%%share/tinker/test/cyclo.key -%%PORTDOCS%%share/tinker/test/cyclo.xyz -%%PORTDOCS%%share/tinker/test/cyclo2.int -%%PORTDOCS%%share/tinker/test/cyclo2.key -%%PORTDOCS%%share/tinker/test/cyclo2.xyz -%%PORTDOCS%%share/tinker/test/dang.key -%%PORTDOCS%%share/tinker/test/dang.xyz -%%PORTDOCS%%share/tinker/test/diamond.key -%%PORTDOCS%%share/tinker/test/diamond.xyz -%%PORTDOCS%%share/tinker/test/diene.int -%%PORTDOCS%%share/tinker/test/diene.key -%%PORTDOCS%%share/tinker/test/diene.xyz -%%PORTDOCS%%share/tinker/test/dimethane.key -%%PORTDOCS%%share/tinker/test/dimethane.xyz -%%PORTDOCS%%share/tinker/test/enkephalin.int -%%PORTDOCS%%share/tinker/test/enkephalin.key -%%PORTDOCS%%share/tinker/test/enkephalin.make -%%PORTDOCS%%share/tinker/test/enkephalin.seq -%%PORTDOCS%%share/tinker/test/enkephalin.xyz -%%PORTDOCS%%share/tinker/test/ermer.int -%%PORTDOCS%%share/tinker/test/ermer.key -%%PORTDOCS%%share/tinker/test/ermer.xyz -%%PORTDOCS%%share/tinker/test/ester.key -%%PORTDOCS%%share/tinker/test/ester.xyz -%%PORTDOCS%%share/tinker/test/ethane.int -%%PORTDOCS%%share/tinker/test/ethane.key -%%PORTDOCS%%share/tinker/test/ethane.xyz -%%PORTDOCS%%share/tinker/test/ethanol.int -%%PORTDOCS%%share/tinker/test/ethanol.key -%%PORTDOCS%%share/tinker/test/ethanol.xyz -%%PORTDOCS%%share/tinker/test/ethylene.int -%%PORTDOCS%%share/tinker/test/ethylene.key -%%PORTDOCS%%share/tinker/test/ethylene.xyz -%%PORTDOCS%%share/tinker/test/flane.int -%%PORTDOCS%%share/tinker/test/flane.key -%%PORTDOCS%%share/tinker/test/flane.xyz -%%PORTDOCS%%share/tinker/test/form.key -%%PORTDOCS%%share/tinker/test/form.xyz -%%PORTDOCS%%share/tinker/test/formbig.key -%%PORTDOCS%%share/tinker/test/formbig.xyz -%%PORTDOCS%%share/tinker/test/formbox.dyn -%%PORTDOCS%%share/tinker/test/formbox.key -%%PORTDOCS%%share/tinker/test/formbox.xyz -%%PORTDOCS%%share/tinker/test/furan.int -%%PORTDOCS%%share/tinker/test/furan.key -%%PORTDOCS%%share/tinker/test/furan.xyz -%%PORTDOCS%%share/tinker/test/glucose.key -%%PORTDOCS%%share/tinker/test/glucose.xyz -%%PORTDOCS%%share/tinker/test/glycerol.dyn -%%PORTDOCS%%share/tinker/test/glycerol.key -%%PORTDOCS%%share/tinker/test/glycerol.xyz -%%PORTDOCS%%share/tinker/test/graphite.key -%%PORTDOCS%%share/tinker/test/graphite.xyz -%%PORTDOCS%%share/tinker/test/helix.dyn -%%PORTDOCS%%share/tinker/test/helix.key -%%PORTDOCS%%share/tinker/test/helix.xyz -%%PORTDOCS%%share/tinker/test/heme.key -%%PORTDOCS%%share/tinker/test/heme.xyz -%%PORTDOCS%%share/tinker/test/hexane.int -%%PORTDOCS%%share/tinker/test/hexane.key -%%PORTDOCS%%share/tinker/test/hexane.xyz -%%PORTDOCS%%share/tinker/test/hexanes.dyn -%%PORTDOCS%%share/tinker/test/hexanes.key -%%PORTDOCS%%share/tinker/test/hexanes.run -%%PORTDOCS%%share/tinker/test/hexanes.xyz -%%PORTDOCS%%share/tinker/test/imidazole.int -%%PORTDOCS%%share/tinker/test/imidazole.key -%%PORTDOCS%%share/tinker/test/imidazole.xyz -%%PORTDOCS%%share/tinker/test/imine.int -%%PORTDOCS%%share/tinker/test/imine.key -%%PORTDOCS%%share/tinker/test/imine.xyz -%%PORTDOCS%%share/tinker/test/lactam.key -%%PORTDOCS%%share/tinker/test/lactam.xyz -%%PORTDOCS%%share/tinker/test/lipid.key -%%PORTDOCS%%share/tinker/test/lipid.xyz -%%PORTDOCS%%share/tinker/test/melittin.key -%%PORTDOCS%%share/tinker/test/melittin.pdb -%%PORTDOCS%%share/tinker/test/melittin.seq -%%PORTDOCS%%share/tinker/test/melittin.xyz -%%PORTDOCS%%share/tinker/test/membrane.key -%%PORTDOCS%%share/tinker/test/membrane.xyz -%%PORTDOCS%%share/tinker/test/methane.int -%%PORTDOCS%%share/tinker/test/methane.key -%%PORTDOCS%%share/tinker/test/methane.xyz -%%PORTDOCS%%share/tinker/test/methanol.key -%%PORTDOCS%%share/tinker/test/methanol.xyz -%%PORTDOCS%%share/tinker/test/mm3.key -%%PORTDOCS%%share/tinker/test/mm3.xyz -%%PORTDOCS%%share/tinker/test/nacl.key -%%PORTDOCS%%share/tinker/test/nacl.xyz -%%PORTDOCS%%share/tinker/test/nada.key -%%PORTDOCS%%share/tinker/test/nada.xyz -%%PORTDOCS%%share/tinker/test/naphthalene.int -%%PORTDOCS%%share/tinker/test/naphthalene.key -%%PORTDOCS%%share/tinker/test/naphthalene.xyz -%%PORTDOCS%%share/tinker/test/nitrogen.dyn -%%PORTDOCS%%share/tinker/test/nitrogen.key -%%PORTDOCS%%share/tinker/test/nitrogen.xyz -%%PORTDOCS%%share/tinker/test/nma.int -%%PORTDOCS%%share/tinker/test/nma.key -%%PORTDOCS%%share/tinker/test/nma.xyz -%%PORTDOCS%%share/tinker/test/nmabox.dyn -%%PORTDOCS%%share/tinker/test/nmabox.key -%%PORTDOCS%%share/tinker/test/nmabox.xyz -%%PORTDOCS%%share/tinker/test/nstilbene.int -%%PORTDOCS%%share/tinker/test/nstilbene.key -%%PORTDOCS%%share/tinker/test/nstilbene.xyz -%%PORTDOCS%%share/tinker/test/octane.int -%%PORTDOCS%%share/tinker/test/octane.key -%%PORTDOCS%%share/tinker/test/octane.xyz -%%PORTDOCS%%share/tinker/test/octane2.int -%%PORTDOCS%%share/tinker/test/octane2.key -%%PORTDOCS%%share/tinker/test/octane2.xyz -%%PORTDOCS%%share/tinker/test/octene.key -%%PORTDOCS%%share/tinker/test/octene.xyz -%%PORTDOCS%%share/tinker/test/palmitate.int -%%PORTDOCS%%share/tinker/test/palmitate.key -%%PORTDOCS%%share/tinker/test/palmitate.xyz -%%PORTDOCS%%share/tinker/test/peptide.int -%%PORTDOCS%%share/tinker/test/peptide.key -%%PORTDOCS%%share/tinker/test/peptide.make -%%PORTDOCS%%share/tinker/test/peptide.pdb -%%PORTDOCS%%share/tinker/test/peptide.seq -%%PORTDOCS%%share/tinker/test/peptide.xyz -%%PORTDOCS%%share/tinker/test/phenanth.key -%%PORTDOCS%%share/tinker/test/phenanth.xyz -%%PORTDOCS%%share/tinker/test/photo.key -%%PORTDOCS%%share/tinker/test/photo.pdb -%%PORTDOCS%%share/tinker/test/photo.seq -%%PORTDOCS%%share/tinker/test/photo.xyz -%%PORTDOCS%%share/tinker/test/pol3.key -%%PORTDOCS%%share/tinker/test/pol3.xyz -%%PORTDOCS%%share/tinker/test/polyala.key -%%PORTDOCS%%share/tinker/test/polyala.xyz -%%PORTDOCS%%share/tinker/test/propane.key -%%PORTDOCS%%share/tinker/test/propane.ray -%%PORTDOCS%%share/tinker/test/propane.xyz -%%PORTDOCS%%share/tinker/test/propellane.int -%%PORTDOCS%%share/tinker/test/propellane.key -%%PORTDOCS%%share/tinker/test/propellane.xyz -%%PORTDOCS%%share/tinker/test/propyne.key -%%PORTDOCS%%share/tinker/test/propyne.xyz -%%PORTDOCS%%share/tinker/test/pyridine.int -%%PORTDOCS%%share/tinker/test/pyridine.key -%%PORTDOCS%%share/tinker/test/pyridine.xyz -%%PORTDOCS%%share/tinker/test/pyrrole.int -%%PORTDOCS%%share/tinker/test/pyrrole.key -%%PORTDOCS%%share/tinker/test/pyrrole.xyz -%%PORTDOCS%%share/tinker/test/retinoic.key -%%PORTDOCS%%share/tinker/test/retinoic.xyz -%%PORTDOCS%%share/tinker/test/skunk.key -%%PORTDOCS%%share/tinker/test/skunk.xyz -%%PORTDOCS%%share/tinker/test/spc.key -%%PORTDOCS%%share/tinker/test/spc.xyz -%%PORTDOCS%%share/tinker/test/sterol.key -%%PORTDOCS%%share/tinker/test/sterol.xyz -%%PORTDOCS%%share/tinker/test/styrene.int -%%PORTDOCS%%share/tinker/test/styrene.key -%%PORTDOCS%%share/tinker/test/styrene.xyz -%%PORTDOCS%%share/tinker/test/terphenyl.key -%%PORTDOCS%%share/tinker/test/terphenyl.xyz -%%PORTDOCS%%share/tinker/test/thiadiene.int -%%PORTDOCS%%share/tinker/test/thiadiene.key -%%PORTDOCS%%share/tinker/test/thiadiene.xyz -%%PORTDOCS%%share/tinker/test/thiophene.int -%%PORTDOCS%%share/tinker/test/thiophene.key -%%PORTDOCS%%share/tinker/test/thiophene.xyz -%%PORTDOCS%%share/tinker/test/thr.int -%%PORTDOCS%%share/tinker/test/thr.key -%%PORTDOCS%%share/tinker/test/thr.xyz -%%PORTDOCS%%share/tinker/test/tip3f.key -%%PORTDOCS%%share/tinker/test/tip3f.xyz -%%PORTDOCS%%share/tinker/test/tip3p.key -%%PORTDOCS%%share/tinker/test/tip3p.xyz -%%PORTDOCS%%share/tinker/test/tip4f.key -%%PORTDOCS%%share/tinker/test/tip4f.xyz -%%PORTDOCS%%share/tinker/test/tip4p.key -%%PORTDOCS%%share/tinker/test/tip4p.xyz -%%PORTDOCS%%share/tinker/test/tip5p.key -%%PORTDOCS%%share/tinker/test/tip5p.xyz -%%PORTDOCS%%share/tinker/test/trpcage.key -%%PORTDOCS%%share/tinker/test/trpcage.pdb -%%PORTDOCS%%share/tinker/test/trpcage.seq -%%PORTDOCS%%share/tinker/test/trpcage.xyz -%%PORTDOCS%%share/tinker/test/water.int -%%PORTDOCS%%share/tinker/test/water.key -%%PORTDOCS%%share/tinker/test/water.xyz -%%PORTDOCS%%share/tinker/test/waterbig.key -%%PORTDOCS%%share/tinker/test/waterbig.xyz -%%PORTDOCS%%share/tinker/test/waterbox.dyn -%%PORTDOCS%%share/tinker/test/waterbox.key -%%PORTDOCS%%share/tinker/test/waterbox.xyz -%%PORTDOCS%%share/tinker/test/waterhuge.key -%%PORTDOCS%%share/tinker/test/waterhuge.xyz -%%PORTDOCS%%share/tinker/test/wateroct.dyn -%%PORTDOCS%%share/tinker/test/wateroct.key -%%PORTDOCS%%share/tinker/test/wateroct.xyz -%%PORTDOCS%%share/tinker/test/watersmall.dyn -%%PORTDOCS%%share/tinker/test/watersmall.key -%%PORTDOCS%%share/tinker/test/watersmall.xyz -%%PORTDOCS%%share/tinker/test/watertiny.dyn -%%PORTDOCS%%share/tinker/test/watertiny.key -%%PORTDOCS%%share/tinker/test/watertiny.xyz -%%PORTDOCS%%share/tinker/test/white.int -%%PORTDOCS%%share/tinker/test/white.key -%%PORTDOCS%%share/tinker/test/white.xyz -share/tinker/tinker.txt +%%PORTDOCS%%%%DATADIR%%/bench/README +%%PORTDOCS%%%%DATADIR%%/bench/bench1.key +%%PORTDOCS%%%%DATADIR%%/bench/bench1.run +%%PORTDOCS%%%%DATADIR%%/bench/bench1.xyz +%%PORTDOCS%%%%DATADIR%%/bench/bench2.key +%%PORTDOCS%%%%DATADIR%%/bench/bench2.run +%%PORTDOCS%%%%DATADIR%%/bench/bench2.xyz +%%PORTDOCS%%%%DATADIR%%/bench/bench3.key +%%PORTDOCS%%%%DATADIR%%/bench/bench3.run +%%PORTDOCS%%%%DATADIR%%/bench/bench3.xyz +%%PORTDOCS%%%%DATADIR%%/bench/bench4.dyn0 +%%PORTDOCS%%%%DATADIR%%/bench/bench4.key +%%PORTDOCS%%%%DATADIR%%/bench/bench4.log +%%PORTDOCS%%%%DATADIR%%/bench/bench4.run +%%PORTDOCS%%%%DATADIR%%/bench/bench4.xyz +%%PORTDOCS%%%%DATADIR%%/bench/bench5.dyn0 +%%PORTDOCS%%%%DATADIR%%/bench/bench5.key +%%PORTDOCS%%%%DATADIR%%/bench/bench5.log +%%PORTDOCS%%%%DATADIR%%/bench/bench5.run +%%PORTDOCS%%%%DATADIR%%/bench/bench5.xyz +%%PORTDOCS%%%%DATADIR%%/bench/results-2.3 +%%PORTDOCS%%%%DATADIR%%/bench/results-2.4 +%%PORTDOCS%%%%DATADIR%%/bench/results-2.9 +%%PORTDOCS%%%%DATADIR%%/bench/results-3.1 +%%PORTDOCS%%%%DATADIR%%/bench/results-3.2 +%%PORTDOCS%%%%DATADIR%%/bench/results-3.4 +%%PORTDOCS%%%%DATADIR%%/bench/results-3.5 +%%PORTDOCS%%%%DATADIR%%/bench/results-3.7 +%%PORTDOCS%%%%DATADIR%%/bench/results-3.8 +%%PORTDOCS%%%%DATADIR%%/bench/results-3.9 +%%PORTDOCS%%%%DATADIR%%/bench/results-4.0 +%%PORTDOCS%%%%DATADIR%%/bench/results-4.1 +%%PORTDOCS%%%%DATADIR%%/bench/results-4.2 +%%DATADIR%%/params/README +%%DATADIR%%/params/amber94.prm +%%DATADIR%%/params/amber96.prm +%%DATADIR%%/params/amber98.prm +%%DATADIR%%/params/amber99.prm +%%DATADIR%%/params/amoeba.prm +%%DATADIR%%/params/amoebapro.prm +%%DATADIR%%/params/charmm19.prm +%%DATADIR%%/params/charmm27.prm +%%DATADIR%%/params/dang.prm +%%DATADIR%%/params/dudek.prm +%%DATADIR%%/params/hoch.prm +%%DATADIR%%/params/mm2.prm +%%DATADIR%%/params/mm3.prm +%%DATADIR%%/params/mm3pro.prm +%%DATADIR%%/params/oplsaa.prm +%%DATADIR%%/params/oplsaal.prm +%%DATADIR%%/params/oplsua.prm +%%DATADIR%%/params/smooth.prm +%%DATADIR%%/params/smoothaa.prm +%%DATADIR%%/params/water.prm +%%WITH_VIEWER%%%%DATADIR%%/rasmol/rasmol.hlp +%%PORTDOCS%%%%DATADIR%%/test/README +%%PORTDOCS%%%%DATADIR%%/test/alkane.key +%%PORTDOCS%%%%DATADIR%%/test/alkane.xyz +%%PORTDOCS%%%%DATADIR%%/test/amoeba.key +%%PORTDOCS%%%%DATADIR%%/test/amoeba.xyz +%%PORTDOCS%%%%DATADIR%%/test/arach.int +%%PORTDOCS%%%%DATADIR%%/test/arach.key +%%PORTDOCS%%%%DATADIR%%/test/arach.xyz +%%PORTDOCS%%%%DATADIR%%/test/azulene.int +%%PORTDOCS%%%%DATADIR%%/test/azulene.key +%%PORTDOCS%%%%DATADIR%%/test/azulene.xyz +%%PORTDOCS%%%%DATADIR%%/test/bdna.int +%%PORTDOCS%%%%DATADIR%%/test/bdna.key +%%PORTDOCS%%%%DATADIR%%/test/bdna.make +%%PORTDOCS%%%%DATADIR%%/test/bdna.seq +%%PORTDOCS%%%%DATADIR%%/test/bdna.xyz +%%PORTDOCS%%%%DATADIR%%/test/bearing.key +%%PORTDOCS%%%%DATADIR%%/test/bearing.xyz +%%PORTDOCS%%%%DATADIR%%/test/bearing2.key +%%PORTDOCS%%%%DATADIR%%/test/bearing2.xyz +%%PORTDOCS%%%%DATADIR%%/test/benzene.int +%%PORTDOCS%%%%DATADIR%%/test/benzene.key +%%PORTDOCS%%%%DATADIR%%/test/benzene.xyz +%%PORTDOCS%%%%DATADIR%%/test/bowl.int +%%PORTDOCS%%%%DATADIR%%/test/bowl.key +%%PORTDOCS%%%%DATADIR%%/test/bowl.xyz +%%PORTDOCS%%%%DATADIR%%/test/bowl2.key +%%PORTDOCS%%%%DATADIR%%/test/bowl2.xyz +%%PORTDOCS%%%%DATADIR%%/test/bowl3.key +%%PORTDOCS%%%%DATADIR%%/test/bowl3.xyz +%%PORTDOCS%%%%DATADIR%%/test/bucky.int +%%PORTDOCS%%%%DATADIR%%/test/bucky.key +%%PORTDOCS%%%%DATADIR%%/test/bucky.xyz +%%PORTDOCS%%%%DATADIR%%/test/butane.int +%%PORTDOCS%%%%DATADIR%%/test/butane.key +%%PORTDOCS%%%%DATADIR%%/test/butane.xyz +%%PORTDOCS%%%%DATADIR%%/test/butane2.int +%%PORTDOCS%%%%DATADIR%%/test/butane2.key +%%PORTDOCS%%%%DATADIR%%/test/butane2.xyz +%%PORTDOCS%%%%DATADIR%%/test/butanes.dyn +%%PORTDOCS%%%%DATADIR%%/test/butanes.key +%%PORTDOCS%%%%DATADIR%%/test/butanes.xyz +%%PORTDOCS%%%%DATADIR%%/test/butanex.key +%%PORTDOCS%%%%DATADIR%%/test/butanex.xyz +%%PORTDOCS%%%%DATADIR%%/test/butopls.int +%%PORTDOCS%%%%DATADIR%%/test/butopls.key +%%PORTDOCS%%%%DATADIR%%/test/butopls.xyz +%%PORTDOCS%%%%DATADIR%%/test/butopls2.int +%%PORTDOCS%%%%DATADIR%%/test/butopls2.key +%%PORTDOCS%%%%DATADIR%%/test/butopls2.xyz +%%PORTDOCS%%%%DATADIR%%/test/c5.key +%%PORTDOCS%%%%DATADIR%%/test/c5.seq +%%PORTDOCS%%%%DATADIR%%/test/c5.xyz +%%PORTDOCS%%%%DATADIR%%/test/c7a.key +%%PORTDOCS%%%%DATADIR%%/test/c7a.seq +%%PORTDOCS%%%%DATADIR%%/test/c7a.xyz +%%PORTDOCS%%%%DATADIR%%/test/c7e.key +%%PORTDOCS%%%%DATADIR%%/test/c7e.seq +%%PORTDOCS%%%%DATADIR%%/test/c7e.xyz +%%PORTDOCS%%%%DATADIR%%/test/calmodulin.key +%%PORTDOCS%%%%DATADIR%%/test/calmodulin.pdb +%%PORTDOCS%%%%DATADIR%%/test/calmodulin.seq +%%PORTDOCS%%%%DATADIR%%/test/calmodulin.xyz +%%PORTDOCS%%%%DATADIR%%/test/copper.key +%%PORTDOCS%%%%DATADIR%%/test/copper.xyz +%%PORTDOCS%%%%DATADIR%%/test/cpentene.key +%%PORTDOCS%%%%DATADIR%%/test/cpentene.xyz +%%PORTDOCS%%%%DATADIR%%/test/crambin.key +%%PORTDOCS%%%%DATADIR%%/test/crambin.pdb +%%PORTDOCS%%%%DATADIR%%/test/crambin.seq +%%PORTDOCS%%%%DATADIR%%/test/crambin.xyz +%%PORTDOCS%%%%DATADIR%%/test/crambinx.key +%%PORTDOCS%%%%DATADIR%%/test/crambinx.ray +%%PORTDOCS%%%%DATADIR%%/test/crambinx.xyz +%%PORTDOCS%%%%DATADIR%%/test/crown.int +%%PORTDOCS%%%%DATADIR%%/test/crown.key +%%PORTDOCS%%%%DATADIR%%/test/crown.xyz +%%PORTDOCS%%%%DATADIR%%/test/cychept.int +%%PORTDOCS%%%%DATADIR%%/test/cychept.key +%%PORTDOCS%%%%DATADIR%%/test/cychept.xyz +%%PORTDOCS%%%%DATADIR%%/test/cyclo.int +%%PORTDOCS%%%%DATADIR%%/test/cyclo.key +%%PORTDOCS%%%%DATADIR%%/test/cyclo.xyz +%%PORTDOCS%%%%DATADIR%%/test/cyclo2.int +%%PORTDOCS%%%%DATADIR%%/test/cyclo2.key +%%PORTDOCS%%%%DATADIR%%/test/cyclo2.xyz +%%PORTDOCS%%%%DATADIR%%/test/dang.key +%%PORTDOCS%%%%DATADIR%%/test/dang.xyz +%%PORTDOCS%%%%DATADIR%%/test/diamond.key +%%PORTDOCS%%%%DATADIR%%/test/diamond.xyz +%%PORTDOCS%%%%DATADIR%%/test/diene.int +%%PORTDOCS%%%%DATADIR%%/test/diene.key +%%PORTDOCS%%%%DATADIR%%/test/diene.xyz +%%PORTDOCS%%%%DATADIR%%/test/dimethane.key +%%PORTDOCS%%%%DATADIR%%/test/dimethane.xyz +%%PORTDOCS%%%%DATADIR%%/test/enkephalin.int +%%PORTDOCS%%%%DATADIR%%/test/enkephalin.key +%%PORTDOCS%%%%DATADIR%%/test/enkephalin.make +%%PORTDOCS%%%%DATADIR%%/test/enkephalin.seq +%%PORTDOCS%%%%DATADIR%%/test/enkephalin.xyz +%%PORTDOCS%%%%DATADIR%%/test/ermer.int +%%PORTDOCS%%%%DATADIR%%/test/ermer.key +%%PORTDOCS%%%%DATADIR%%/test/ermer.xyz +%%PORTDOCS%%%%DATADIR%%/test/ester.key +%%PORTDOCS%%%%DATADIR%%/test/ester.xyz +%%PORTDOCS%%%%DATADIR%%/test/ethane.int +%%PORTDOCS%%%%DATADIR%%/test/ethane.key +%%PORTDOCS%%%%DATADIR%%/test/ethane.xyz +%%PORTDOCS%%%%DATADIR%%/test/ethanol.int +%%PORTDOCS%%%%DATADIR%%/test/ethanol.key +%%PORTDOCS%%%%DATADIR%%/test/ethanol.xyz +%%PORTDOCS%%%%DATADIR%%/test/ethylene.int +%%PORTDOCS%%%%DATADIR%%/test/ethylene.key +%%PORTDOCS%%%%DATADIR%%/test/ethylene.xyz +%%PORTDOCS%%%%DATADIR%%/test/flane.int +%%PORTDOCS%%%%DATADIR%%/test/flane.key +%%PORTDOCS%%%%DATADIR%%/test/flane.xyz +%%PORTDOCS%%%%DATADIR%%/test/form.key +%%PORTDOCS%%%%DATADIR%%/test/form.xyz +%%PORTDOCS%%%%DATADIR%%/test/formbig.key +%%PORTDOCS%%%%DATADIR%%/test/formbig.xyz +%%PORTDOCS%%%%DATADIR%%/test/formbox.dyn +%%PORTDOCS%%%%DATADIR%%/test/formbox.key +%%PORTDOCS%%%%DATADIR%%/test/formbox.xyz +%%PORTDOCS%%%%DATADIR%%/test/furan.int +%%PORTDOCS%%%%DATADIR%%/test/furan.key +%%PORTDOCS%%%%DATADIR%%/test/furan.xyz +%%PORTDOCS%%%%DATADIR%%/test/glucose.key +%%PORTDOCS%%%%DATADIR%%/test/glucose.xyz +%%PORTDOCS%%%%DATADIR%%/test/glycerol.dyn +%%PORTDOCS%%%%DATADIR%%/test/glycerol.key +%%PORTDOCS%%%%DATADIR%%/test/glycerol.xyz +%%PORTDOCS%%%%DATADIR%%/test/graphite.key +%%PORTDOCS%%%%DATADIR%%/test/graphite.xyz +%%PORTDOCS%%%%DATADIR%%/test/helix.dyn +%%PORTDOCS%%%%DATADIR%%/test/helix.key +%%PORTDOCS%%%%DATADIR%%/test/helix.xyz +%%PORTDOCS%%%%DATADIR%%/test/heme.key +%%PORTDOCS%%%%DATADIR%%/test/heme.xyz +%%PORTDOCS%%%%DATADIR%%/test/hexane.int +%%PORTDOCS%%%%DATADIR%%/test/hexane.key +%%PORTDOCS%%%%DATADIR%%/test/hexane.xyz +%%PORTDOCS%%%%DATADIR%%/test/hexanes.dyn +%%PORTDOCS%%%%DATADIR%%/test/hexanes.key +%%PORTDOCS%%%%DATADIR%%/test/hexanes.xyz +%%PORTDOCS%%%%DATADIR%%/test/imidazole.int +%%PORTDOCS%%%%DATADIR%%/test/imidazole.key +%%PORTDOCS%%%%DATADIR%%/test/imidazole.xyz +%%PORTDOCS%%%%DATADIR%%/test/imine.int +%%PORTDOCS%%%%DATADIR%%/test/imine.key +%%PORTDOCS%%%%DATADIR%%/test/imine.xyz +%%PORTDOCS%%%%DATADIR%%/test/lactam.key +%%PORTDOCS%%%%DATADIR%%/test/lactam.xyz +%%PORTDOCS%%%%DATADIR%%/test/lipid.key +%%PORTDOCS%%%%DATADIR%%/test/lipid.xyz +%%PORTDOCS%%%%DATADIR%%/test/melittin.key +%%PORTDOCS%%%%DATADIR%%/test/melittin.pdb +%%PORTDOCS%%%%DATADIR%%/test/melittin.seq +%%PORTDOCS%%%%DATADIR%%/test/melittin.xyz +%%PORTDOCS%%%%DATADIR%%/test/membrane.key +%%PORTDOCS%%%%DATADIR%%/test/membrane.xyz +%%PORTDOCS%%%%DATADIR%%/test/methane.int +%%PORTDOCS%%%%DATADIR%%/test/methane.key +%%PORTDOCS%%%%DATADIR%%/test/methane.xyz +%%PORTDOCS%%%%DATADIR%%/test/methanol.key +%%PORTDOCS%%%%DATADIR%%/test/methanol.xyz +%%PORTDOCS%%%%DATADIR%%/test/mm3.key +%%PORTDOCS%%%%DATADIR%%/test/mm3.xyz +%%PORTDOCS%%%%DATADIR%%/test/nacl.key +%%PORTDOCS%%%%DATADIR%%/test/nacl.xyz +%%PORTDOCS%%%%DATADIR%%/test/nada.key +%%PORTDOCS%%%%DATADIR%%/test/nada.xyz +%%PORTDOCS%%%%DATADIR%%/test/naphthalene.int +%%PORTDOCS%%%%DATADIR%%/test/naphthalene.key +%%PORTDOCS%%%%DATADIR%%/test/naphthalene.xyz +%%PORTDOCS%%%%DATADIR%%/test/nitrogen.dyn +%%PORTDOCS%%%%DATADIR%%/test/nitrogen.key +%%PORTDOCS%%%%DATADIR%%/test/nitrogen.xyz +%%PORTDOCS%%%%DATADIR%%/test/nma.int +%%PORTDOCS%%%%DATADIR%%/test/nma.key +%%PORTDOCS%%%%DATADIR%%/test/nma.xyz +%%PORTDOCS%%%%DATADIR%%/test/nmabox.dyn +%%PORTDOCS%%%%DATADIR%%/test/nmabox.key +%%PORTDOCS%%%%DATADIR%%/test/nmabox.xyz +%%PORTDOCS%%%%DATADIR%%/test/nstilbene.int +%%PORTDOCS%%%%DATADIR%%/test/nstilbene.key +%%PORTDOCS%%%%DATADIR%%/test/nstilbene.xyz +%%PORTDOCS%%%%DATADIR%%/test/octane.int +%%PORTDOCS%%%%DATADIR%%/test/octane.key +%%PORTDOCS%%%%DATADIR%%/test/octane.xyz +%%PORTDOCS%%%%DATADIR%%/test/octane2.int +%%PORTDOCS%%%%DATADIR%%/test/octane2.key +%%PORTDOCS%%%%DATADIR%%/test/octane2.xyz +%%PORTDOCS%%%%DATADIR%%/test/octene.key +%%PORTDOCS%%%%DATADIR%%/test/octene.xyz +%%PORTDOCS%%%%DATADIR%%/test/palmitate.int +%%PORTDOCS%%%%DATADIR%%/test/palmitate.key +%%PORTDOCS%%%%DATADIR%%/test/palmitate.xyz +%%PORTDOCS%%%%DATADIR%%/test/peptide.int +%%PORTDOCS%%%%DATADIR%%/test/peptide.key +%%PORTDOCS%%%%DATADIR%%/test/peptide.make +%%PORTDOCS%%%%DATADIR%%/test/peptide.pdb +%%PORTDOCS%%%%DATADIR%%/test/peptide.seq +%%PORTDOCS%%%%DATADIR%%/test/peptide.xyz +%%PORTDOCS%%%%DATADIR%%/test/phenanth.key +%%PORTDOCS%%%%DATADIR%%/test/phenanth.xyz +%%PORTDOCS%%%%DATADIR%%/test/photo.key +%%PORTDOCS%%%%DATADIR%%/test/photo.pdb +%%PORTDOCS%%%%DATADIR%%/test/photo.seq +%%PORTDOCS%%%%DATADIR%%/test/photo.xyz +%%PORTDOCS%%%%DATADIR%%/test/pol3.key +%%PORTDOCS%%%%DATADIR%%/test/pol3.xyz +%%PORTDOCS%%%%DATADIR%%/test/polyala.key +%%PORTDOCS%%%%DATADIR%%/test/polyala.xyz +%%PORTDOCS%%%%DATADIR%%/test/propane.key +%%PORTDOCS%%%%DATADIR%%/test/propane.ray +%%PORTDOCS%%%%DATADIR%%/test/propane.xyz +%%PORTDOCS%%%%DATADIR%%/test/propellane.int +%%PORTDOCS%%%%DATADIR%%/test/propellane.key +%%PORTDOCS%%%%DATADIR%%/test/propellane.xyz +%%PORTDOCS%%%%DATADIR%%/test/propyne.key +%%PORTDOCS%%%%DATADIR%%/test/propyne.xyz +%%PORTDOCS%%%%DATADIR%%/test/pyridine.int +%%PORTDOCS%%%%DATADIR%%/test/pyridine.key +%%PORTDOCS%%%%DATADIR%%/test/pyridine.xyz +%%PORTDOCS%%%%DATADIR%%/test/pyrrole.int +%%PORTDOCS%%%%DATADIR%%/test/pyrrole.key +%%PORTDOCS%%%%DATADIR%%/test/pyrrole.xyz +%%PORTDOCS%%%%DATADIR%%/test/retinoic.key +%%PORTDOCS%%%%DATADIR%%/test/retinoic.xyz +%%PORTDOCS%%%%DATADIR%%/test/skunk.key +%%PORTDOCS%%%%DATADIR%%/test/skunk.xyz +%%PORTDOCS%%%%DATADIR%%/test/spc.key +%%PORTDOCS%%%%DATADIR%%/test/spc.xyz +%%PORTDOCS%%%%DATADIR%%/test/sterol.key +%%PORTDOCS%%%%DATADIR%%/test/sterol.xyz +%%PORTDOCS%%%%DATADIR%%/test/styrene.int +%%PORTDOCS%%%%DATADIR%%/test/styrene.key +%%PORTDOCS%%%%DATADIR%%/test/styrene.xyz +%%PORTDOCS%%%%DATADIR%%/test/terphenyl.key +%%PORTDOCS%%%%DATADIR%%/test/terphenyl.xyz +%%PORTDOCS%%%%DATADIR%%/test/tfe.key +%%PORTDOCS%%%%DATADIR%%/test/tfe.xyz +%%PORTDOCS%%%%DATADIR%%/test/thiadiene.int +%%PORTDOCS%%%%DATADIR%%/test/thiadiene.key +%%PORTDOCS%%%%DATADIR%%/test/thiadiene.xyz +%%PORTDOCS%%%%DATADIR%%/test/thiophene.int +%%PORTDOCS%%%%DATADIR%%/test/thiophene.key +%%PORTDOCS%%%%DATADIR%%/test/thiophene.xyz +%%PORTDOCS%%%%DATADIR%%/test/thr.int +%%PORTDOCS%%%%DATADIR%%/test/thr.key +%%PORTDOCS%%%%DATADIR%%/test/thr.xyz +%%PORTDOCS%%%%DATADIR%%/test/tip3f.key +%%PORTDOCS%%%%DATADIR%%/test/tip3f.xyz +%%PORTDOCS%%%%DATADIR%%/test/tip3p.key +%%PORTDOCS%%%%DATADIR%%/test/tip3p.xyz +%%PORTDOCS%%%%DATADIR%%/test/tip4f.key +%%PORTDOCS%%%%DATADIR%%/test/tip4f.xyz +%%PORTDOCS%%%%DATADIR%%/test/tip4p.key +%%PORTDOCS%%%%DATADIR%%/test/tip4p.xyz +%%PORTDOCS%%%%DATADIR%%/test/tip5p.key +%%PORTDOCS%%%%DATADIR%%/test/tip5p.xyz +%%PORTDOCS%%%%DATADIR%%/test/trpcage.key +%%PORTDOCS%%%%DATADIR%%/test/trpcage.pdb +%%PORTDOCS%%%%DATADIR%%/test/trpcage.seq +%%PORTDOCS%%%%DATADIR%%/test/trpcage.xyz +%%PORTDOCS%%%%DATADIR%%/test/water.int +%%PORTDOCS%%%%DATADIR%%/test/water.key +%%PORTDOCS%%%%DATADIR%%/test/water.xyz +%%PORTDOCS%%%%DATADIR%%/test/waterbig.key +%%PORTDOCS%%%%DATADIR%%/test/waterbig.xyz +%%PORTDOCS%%%%DATADIR%%/test/waterbox.dyn +%%PORTDOCS%%%%DATADIR%%/test/waterbox.key +%%PORTDOCS%%%%DATADIR%%/test/waterbox.xyz +%%PORTDOCS%%%%DATADIR%%/test/waterdot.dyn +%%PORTDOCS%%%%DATADIR%%/test/waterdot.key +%%PORTDOCS%%%%DATADIR%%/test/waterdot.xyz +%%PORTDOCS%%%%DATADIR%%/test/waterhuge.key +%%PORTDOCS%%%%DATADIR%%/test/waterhuge.xyz +%%PORTDOCS%%%%DATADIR%%/test/watersmall.dyn +%%PORTDOCS%%%%DATADIR%%/test/watersmall.key +%%PORTDOCS%%%%DATADIR%%/test/watersmall.xyz +%%PORTDOCS%%%%DATADIR%%/test/watertiny.dyn +%%PORTDOCS%%%%DATADIR%%/test/watertiny.key +%%PORTDOCS%%%%DATADIR%%/test/watertiny.xyz +%%PORTDOCS%%%%DATADIR%%/test/white.int +%%PORTDOCS%%%%DATADIR%%/test/white.key +%%PORTDOCS%%%%DATADIR%%/test/white.xyz +%%DATADIR%%/tinker.txt %%PORTDOCS%%@dirrm %%DOCSDIR%% %%PORTDOCS%%@dirrm share/examples/tinker -%%PORTDOCS%%@dirrm share/tinker/bench -@dirrm share/tinker/params -%%WITH_VIEWER%%@dirrm share/tinker/rasmol -%%PORTDOCS%%@dirrm share/tinker/test -@dirrm share/tinker +%%PORTDOCS%%@dirrm %%DATADIR%%/bench +@dirrm %%DATADIR%%/params +%%WITH_VIEWER%%@dirrm %%DATADIR%%/rasmol +%%PORTDOCS%%@dirrm %%DATADIR%%/test +@dirrm %%DATADIR%% |