diff options
Diffstat (limited to 'biology/tinker/pkg-plist')
| -rw-r--r-- | biology/tinker/pkg-plist | 113 |
1 files changed, 63 insertions, 50 deletions
diff --git a/biology/tinker/pkg-plist b/biology/tinker/pkg-plist index 80f3c8486d6d..63f55046e0dc 100644 --- a/biology/tinker/pkg-plist +++ b/biology/tinker/pkg-plist @@ -24,6 +24,7 @@ bin/pss bin/pssrigid bin/pssrot bin/saddle +bin/scan bin/sniffer bin/spacefill bin/superpose @@ -42,31 +43,40 @@ bin/xyzedit bin/xyzint bin/xyzpdb bin/xyzsybyl -share/tinker/params/README -share/tinker/params/amber.prm -share/tinker/params/charmm.prm -share/tinker/params/emr.prm -share/tinker/params/hoch.prm -share/tinker/params/merck.prm -share/tinker/params/mm2.prm -share/tinker/params/mm3.prm -share/tinker/params/mm3pro.prm -share/tinker/params/mmffpro.prm -share/tinker/params/opls.prm -share/tinker/params/oplsaa.prm -share/tinker/params/smooth.prm -share/tinker/params/tinker.prm -share/tinker/params/water.prm +share/tinker/bench/crambin.input +share/tinker/bench/crambin.key +share/tinker/bench/crambin.run +share/tinker/bench/crambin.xyz +share/tinker/bench/crystal.input +share/tinker/bench/crystal.key +share/tinker/bench/crystal.run +share/tinker/bench/crystal.xyz +share/tinker/bench/results-2.3 +share/tinker/bench/results-2.4 +share/tinker/bench/results-2.9 +share/tinker/bench/results-3.1 +share/tinker/bench/results-3.2 +share/tinker/bench/results-3.4 +share/tinker/bench/results-3.5 +share/tinker/bench/results-3.7 +share/tinker/bench/water.dyn0 +share/tinker/bench/water.input +share/tinker/bench/water.key +share/tinker/bench/water.run +share/tinker/bench/water.xyz share/tinker/doc/README +share/tinker/doc/guide.pdf share/tinker/doc/guide.ps.Z share/tinker/doc/guide.txt +share/tinker/doc/license.pdf share/tinker/doc/license.ps share/tinker/doc/license.txt +share/tinker/doc/logo-bind.ps.Z share/tinker/doc/logo.ps.Z share/tinker/doc/spine.ps +share/tinker/doc/summary.pdf share/tinker/doc/summary.ps share/tinker/doc/summary.txt -share/tinker/tinker.txt share/tinker/example/README share/tinker/example/anion.dyn0 share/tinker/example/anion.in1 @@ -116,26 +126,25 @@ share/tinker/example/formamide.in4 share/tinker/example/formamide.key share/tinker/example/formamide.log share/tinker/example/formamide.run -share/tinker/bench/crambin.input -share/tinker/bench/crambin.key -share/tinker/bench/crambin.run -share/tinker/bench/crambin.xyz -share/tinker/bench/crystal.input -share/tinker/bench/crystal.key -share/tinker/bench/crystal.run -share/tinker/bench/crystal.xyz -share/tinker/bench/results-2.3 -share/tinker/bench/results-2.4 -share/tinker/bench/results-2.9 -share/tinker/bench/results-3.1 -share/tinker/bench/results-3.2 -share/tinker/bench/results-3.4 -share/tinker/bench/results-3.5 -share/tinker/bench/water.dyn0 -share/tinker/bench/water.input -share/tinker/bench/water.key -share/tinker/bench/water.run -share/tinker/bench/water.xyz +share/tinker/example/helix.in1 +share/tinker/example/helix.key +share/tinker/example/helix.log +share/tinker/example/helix.run +share/tinker/example/helix.xyz +share/tinker/params/README +share/tinker/params/amber.prm +share/tinker/params/charmm.prm +share/tinker/params/emr.prm +share/tinker/params/hoch.prm +share/tinker/params/mm2.prm +share/tinker/params/mm3.prm +share/tinker/params/mm3pro.prm +share/tinker/params/opls.prm +share/tinker/params/oplsaa.prm +share/tinker/params/smooth.prm +share/tinker/params/smoothaa.prm +share/tinker/params/tinker.prm +share/tinker/params/water.prm share/tinker/test/README share/tinker/test/ala20.key share/tinker/test/ala20.xyz @@ -148,15 +157,16 @@ share/tinker/test/annulene3.key share/tinker/test/annulene3.xyz share/tinker/test/arach.int share/tinker/test/arach.key -share/tinker/test/arach.xmol share/tinker/test/arach.xyz share/tinker/test/azulene.int share/tinker/test/azulene.key share/tinker/test/azulene.xyz -share/tinker/test/bearing.big share/tinker/test/bearing.key share/tinker/test/bearing.pdb share/tinker/test/bearing.xyz +share/tinker/test/bearing2.key +share/tinker/test/bearing2.pdb +share/tinker/test/bearing2.xyz share/tinker/test/benzene.int share/tinker/test/benzene.key share/tinker/test/benzene.xyz @@ -177,29 +187,30 @@ share/tinker/test/butopls.xyz share/tinker/test/butopls2.int share/tinker/test/butopls2.key share/tinker/test/butopls2.xyz -share/tinker/test/c5.int share/tinker/test/c5.key +share/tinker/test/c5.seq share/tinker/test/c5.xyz -share/tinker/test/c7ax.int share/tinker/test/c7ax.key +share/tinker/test/c7ax.seq share/tinker/test/c7ax.xyz -share/tinker/test/c7eq.int share/tinker/test/c7eq.key +share/tinker/test/c7eq.seq share/tinker/test/c7eq.xyz share/tinker/test/cpentene.key share/tinker/test/cpentene.xyz -share/tinker/test/crambin.int share/tinker/test/crambin.key share/tinker/test/crambin.pdb share/tinker/test/crambin.seq share/tinker/test/crambin.xyz share/tinker/test/crambinx.key +share/tinker/test/crambinx.ray share/tinker/test/crambinx.xyz share/tinker/test/crown.int share/tinker/test/crown.key share/tinker/test/crown.xyz share/tinker/test/cychept.int share/tinker/test/cychept.key +share/tinker/test/cychept.pdb share/tinker/test/cychept.xyz share/tinker/test/cyclo.int share/tinker/test/cyclo.key @@ -207,24 +218,26 @@ share/tinker/test/cyclo.xyz share/tinker/test/cyclo2.int share/tinker/test/cyclo2.key share/tinker/test/cyclo2.xyz -share/tinker/test/nma.int share/tinker/test/diene.int share/tinker/test/diene.key share/tinker/test/diene.xyz share/tinker/test/dimethane.key share/tinker/test/dimethane.xyz share/tinker/test/diwater.key -share/tinker/test/diwater.lin +share/tinker/test/diwater.min share/tinker/test/diwater.xyz share/tinker/test/enkephalin.int share/tinker/test/enkephalin.key share/tinker/test/enkephalin.make share/tinker/test/enkephalin.pdb +share/tinker/test/enkephalin.run share/tinker/test/enkephalin.seq share/tinker/test/enkephalin.xyz share/tinker/test/ermer.int share/tinker/test/ermer.key share/tinker/test/ermer.xyz +share/tinker/test/ester.key +share/tinker/test/ester.xyz share/tinker/test/ethane.int share/tinker/test/ethane.key share/tinker/test/ethane.xyz @@ -234,6 +247,8 @@ share/tinker/test/ethylene.xyz share/tinker/test/flane.int share/tinker/test/flane.key share/tinker/test/flane.xyz +share/tinker/test/formamide.key +share/tinker/test/formamide.xyz share/tinker/test/furan.int share/tinker/test/furan.key share/tinker/test/furan.xyz @@ -254,6 +269,7 @@ share/tinker/test/methane.key share/tinker/test/methane.xyz share/tinker/test/methanol.key share/tinker/test/methanol.xyz +share/tinker/test/nma.int share/tinker/test/nma.key share/tinker/test/nma.xyz share/tinker/test/nmabox.dyn @@ -280,10 +296,6 @@ share/tinker/test/peptide.seq share/tinker/test/peptide.xyz share/tinker/test/phenanth.key share/tinker/test/phenanth.xyz -share/tinker/test/photo.key -share/tinker/test/photo.pdb -share/tinker/test/photo.seq -share/tinker/test/photo.xyz share/tinker/test/propellane.int share/tinker/test/propellane.key share/tinker/test/propellane.xyz @@ -328,9 +340,10 @@ share/tinker/test/watersmall.xyz share/tinker/test/white.int share/tinker/test/white.key share/tinker/test/white.xyz -@dirrm share/tinker/params +share/tinker/tinker.txt +@dirrm share/tinker/bench @dirrm share/tinker/doc @dirrm share/tinker/example -@dirrm share/tinker/bench +@dirrm share/tinker/params @dirrm share/tinker/test @dirrm share/tinker |