View | Details | Raw Unified | Return to bug 33425
Collapse All | Expand All

(-)tinker/Makefile (-3 / +4 lines)
Lines 7-12 Link Here
7
7
8
PORTNAME=	tinker
8
PORTNAME=	tinker
9
PORTVERSION=	3.9
9
PORTVERSION=	3.9
10
PORTREVISION=	1
10
CATEGORIES=	biology
11
CATEGORIES=	biology
11
MASTER_SITES=	ftp://dasher.wustl.edu/pub/
12
MASTER_SITES=	ftp://dasher.wustl.edu/pub/
12
DISTNAME=	${PORTNAME}
13
DISTNAME=	${PORTNAME}
Lines 28-34 Link Here
28
	@${ECHO_MSG} If you get a CHECKSUM mismatch, try doing a \'make distclean\' first.
29
	@${ECHO_MSG} If you get a CHECKSUM mismatch, try doing a \'make distclean\' first.
29
	@${ECHO_MSG} ""
30
	@${ECHO_MSG} ""
30
31
31
.if defined(WANT_VIEWER)
32
.if defined(WITH_VIEWER)
32
.if ${XFREE86_VERSION} == 3
33
.if ${XFREE86_VERSION} == 3
33
BUILD_DEPENDS+=	imake:${PORTSDIR}/devel/imake
34
BUILD_DEPENDS+=	imake:${PORTSDIR}/devel/imake
34
.elif ${XFREE86_VERSION} == 4
35
.elif ${XFREE86_VERSION} == 4
Lines 42-48 Link Here
42
pre-extract:
43
pre-extract:
43
	@${ECHO} ""
44
	@${ECHO} ""
44
	@${ECHO} If you would like to also build
45
	@${ECHO} If you would like to also build
45
	@${ECHO} the molecular viewer, define WANT_VIEWER.
46
	@${ECHO} the molecular viewer, define WITH_VIEWER.
46
	@${ECHO} ""
47
	@${ECHO} ""
47
.endif
48
.endif
48
49
Lines 114-120 Link Here
114
	@${INSTALL_DATA} ${WRKDIR}/tinker/test/* ${PREFIX}/share/tinker/test
115
	@${INSTALL_DATA} ${WRKDIR}/tinker/test/* ${PREFIX}/share/tinker/test
115
.endif
116
.endif
116
117
117
.if defined(WANT_VIEWER)
118
.if defined(WITH_VIEWER)
118
	@${MKDIR} ${PREFIX}/share/tinker/rasmol
119
	@${MKDIR} ${PREFIX}/share/tinker/rasmol
119
	@${INSTALL_PROGRAM} ${WRKDIR}/tinker/rasmol/tview-* ${PREFIX}/bin
120
	@${INSTALL_PROGRAM} ${WRKDIR}/tinker/rasmol/tview-* ${PREFIX}/bin
120
	@${INSTALL_SCRIPT} ${FILESDIR}/tview ${PREFIX}/bin
121
	@${INSTALL_SCRIPT} ${FILESDIR}/tview ${PREFIX}/bin
(-)tinker/distinfo (-1 / +1 lines)
Line 1 Link Here
1
MD5 (tinker.tar.gz) = a48fc15fe668f8e41d0cc3316a582928
1
MD5 (tinker.tar.gz) = e6f34c61cc40f107fbbcf4b0c7dae5a5
(-)tinker/files/patch-aa (-14 / +6 lines)
Lines 1-5 Link Here
1
--- ../make/Makefile.orig	Sat Jul 21 10:04:48 2001
1
--- ../make/Makefile.orig	Tue Nov 13 10:16:27 2001
2
+++ ../make/Makefile	Wed Sep  5 13:51:19 2001
2
+++ ../make/Makefile	Mon Dec 31 15:33:40 2001
3
@@ -9,8 +9,8 @@
3
@@ -9,8 +9,8 @@
4
 ##
4
 ##
5
 ##   1. make all              Build all the TINKER executables
5
 ##   1. make all              Build all the TINKER executables
Lines 68-74 Link Here
68
 #################################################################
68
 #################################################################
69
 ##  Should not be Necessary to Change Things Below this Point  ##
69
 ##  Should not be Necessary to Change Things Below this Point  ##
70
 #################################################################
70
 #################################################################
71
@@ -494,11 +512,13 @@
71
@@ -497,11 +515,13 @@
72
            xyzpdb.x \
72
            xyzpdb.x \
73
            xyzsybyl.x
73
            xyzsybyl.x
74
 
74
 
Lines 84-90 Link Here
84
 
84
 
85
 all:	${EXEFILES}
85
 all:	${EXEFILES}
86
 
86
 
87
@@ -509,57 +529,57 @@
87
@@ -512,58 +532,58 @@
88
 	cat *.i *.f > tinker.txt
88
 	cat *.i *.f > tinker.txt
89
 
89
 
90
 rename:
90
 rename:
Lines 104-109 Link Here
104
-	mv  minimize.x   $(BINDIR)/minimize
104
-	mv  minimize.x   $(BINDIR)/minimize
105
-	mv  minirot.x    $(BINDIR)/minirot
105
-	mv  minirot.x    $(BINDIR)/minirot
106
-	mv  minrigid.x   $(BINDIR)/minrigid
106
-	mv  minrigid.x   $(BINDIR)/minrigid
107
-	mv  monte.x      $(BINDIR)/monte
107
-	mv  newton.x     $(BINDIR)/newton
108
-	mv  newton.x     $(BINDIR)/newton
108
-	mv  newtrot.x    $(BINDIR)/newtrot
109
-	mv  newtrot.x    $(BINDIR)/newtrot
109
-	mv  nucleic.x    $(BINDIR)/nucleic
110
-	mv  nucleic.x    $(BINDIR)/nucleic
Lines 155-160 Link Here
155
+	${INSTALL_PROGRAM}  minimize.x   $(BINDIR)/minimize
156
+	${INSTALL_PROGRAM}  minimize.x   $(BINDIR)/minimize
156
+	${INSTALL_PROGRAM}  minirot.x    $(BINDIR)/minirot
157
+	${INSTALL_PROGRAM}  minirot.x    $(BINDIR)/minirot
157
+	${INSTALL_PROGRAM}  minrigid.x   $(BINDIR)/minrigid
158
+	${INSTALL_PROGRAM}  minrigid.x   $(BINDIR)/minrigid
159
+	${INSTALL_PROGRAM}  monte.x      $(BINDIR)/monte
158
+	${INSTALL_PROGRAM}  newton.x     $(BINDIR)/newton
160
+	${INSTALL_PROGRAM}  newton.x     $(BINDIR)/newton
159
+	${INSTALL_PROGRAM}  newtrot.x    $(BINDIR)/newtrot
161
+	${INSTALL_PROGRAM}  newtrot.x    $(BINDIR)/newtrot
160
+	${INSTALL_PROGRAM}  nucleic.x    $(BINDIR)/nucleic
162
+	${INSTALL_PROGRAM}  nucleic.x    $(BINDIR)/nucleic
Lines 193-205 Link Here
193
 
195
 
194
 remove_links:
196
 remove_links:
195
 	rm -f $(LINKDIR)/alchemy
197
 	rm -f $(LINKDIR)/alchemy
196
@@ -682,8 +702,8 @@
197
         bspline.o \
198
         calendar.o \
199
         center.o \
200
-        chkxyz.o \
201
         cholesky.o \
202
+        chkxyz.o \
203
         clock.o \
204
         cluster.o \
205
         column.o \
(-)tinker/pkg-plist (-22 / +44 lines)
Lines 14-19 Link Here
14
bin/minimize
14
bin/minimize
15
bin/minirot
15
bin/minirot
16
bin/minrigid
16
bin/minrigid
17
bin/monte
17
bin/newton
18
bin/newton
18
bin/newtrot
19
bin/newtrot
19
bin/nucleic
20
bin/nucleic
Lines 139-157 Link Here
139
%%PORTDOCS%%share/tinker/bench/results-3.7
140
%%PORTDOCS%%share/tinker/bench/results-3.7
140
%%PORTDOCS%%share/tinker/bench/results-3.8
141
%%PORTDOCS%%share/tinker/bench/results-3.8
141
%%PORTDOCS%%share/tinker/bench/results-3.9
142
%%PORTDOCS%%share/tinker/bench/results-3.9
142
%%PORTDOCS%%share/tinker/params/README
143
share/tinker/params/README
143
%%PORTDOCS%%share/tinker/params/amber.prm
144
share/tinker/params/amber.prm
144
%%PORTDOCS%%share/tinker/params/charmm.prm
145
share/tinker/params/charmm.prm
145
%%PORTDOCS%%share/tinker/params/dudek.prm
146
share/tinker/params/hoch.prm
146
%%PORTDOCS%%share/tinker/params/hoch.prm
147
share/tinker/params/mm2.prm
147
%%PORTDOCS%%share/tinker/params/mm2.prm
148
share/tinker/params/mm3.prm
148
%%PORTDOCS%%share/tinker/params/mm3.prm
149
share/tinker/params/mm3pro.prm
149
%%PORTDOCS%%share/tinker/params/mm3pro.prm
150
share/tinker/params/opls.prm
150
%%PORTDOCS%%share/tinker/params/opls.prm
151
share/tinker/params/oplsaa.prm
151
%%PORTDOCS%%share/tinker/params/oplsaa.prm
152
share/tinker/params/smooth.prm
152
%%PORTDOCS%%share/tinker/params/smooth.prm
153
share/tinker/params/smoothaa.prm
153
%%PORTDOCS%%share/tinker/params/smoothaa.prm
154
share/tinker/params/water.prm
154
%%PORTDOCS%%share/tinker/params/water.prm
155
%%PORTDOCS%%share/tinker/test/README
155
%%PORTDOCS%%share/tinker/test/README
156
%%PORTDOCS%%share/tinker/test/ala20.key
156
%%PORTDOCS%%share/tinker/test/ala20.key
157
%%PORTDOCS%%share/tinker/test/ala20.xyz
157
%%PORTDOCS%%share/tinker/test/ala20.xyz
Lines 182-187 Link Here
182
%%PORTDOCS%%share/tinker/test/bowl2.xyz
182
%%PORTDOCS%%share/tinker/test/bowl2.xyz
183
%%PORTDOCS%%share/tinker/test/bowl3.key
183
%%PORTDOCS%%share/tinker/test/bowl3.key
184
%%PORTDOCS%%share/tinker/test/bowl3.xyz
184
%%PORTDOCS%%share/tinker/test/bowl3.xyz
185
%%PORTDOCS%%share/tinker/test/bucky.int
186
%%PORTDOCS%%share/tinker/test/bucky.key
187
%%PORTDOCS%%share/tinker/test/bucky.xyz
185
%%PORTDOCS%%share/tinker/test/butane.int
188
%%PORTDOCS%%share/tinker/test/butane.int
186
%%PORTDOCS%%share/tinker/test/butane.key
189
%%PORTDOCS%%share/tinker/test/butane.key
187
%%PORTDOCS%%share/tinker/test/butane.xyz
190
%%PORTDOCS%%share/tinker/test/butane.xyz
Lines 202-213 Link Here
202
%%PORTDOCS%%share/tinker/test/c5.key
205
%%PORTDOCS%%share/tinker/test/c5.key
203
%%PORTDOCS%%share/tinker/test/c5.seq
206
%%PORTDOCS%%share/tinker/test/c5.seq
204
%%PORTDOCS%%share/tinker/test/c5.xyz
207
%%PORTDOCS%%share/tinker/test/c5.xyz
205
%%PORTDOCS%%share/tinker/test/c7ax.key
208
%%PORTDOCS%%share/tinker/test/c7a.key
206
%%PORTDOCS%%share/tinker/test/c7ax.seq
209
%%PORTDOCS%%share/tinker/test/c7a.seq
207
%%PORTDOCS%%share/tinker/test/c7ax.xyz
210
%%PORTDOCS%%share/tinker/test/c7a.xyz
208
%%PORTDOCS%%share/tinker/test/c7eq.key
211
%%PORTDOCS%%share/tinker/test/c7e.key
209
%%PORTDOCS%%share/tinker/test/c7eq.seq
212
%%PORTDOCS%%share/tinker/test/c7e.seq
210
%%PORTDOCS%%share/tinker/test/c7eq.xyz
213
%%PORTDOCS%%share/tinker/test/c7e.xyz
211
%%PORTDOCS%%share/tinker/test/calmodulin.key
214
%%PORTDOCS%%share/tinker/test/calmodulin.key
212
%%PORTDOCS%%share/tinker/test/calmodulin.pdb
215
%%PORTDOCS%%share/tinker/test/calmodulin.pdb
213
%%PORTDOCS%%share/tinker/test/calmodulin.seq
216
%%PORTDOCS%%share/tinker/test/calmodulin.seq
Lines 245-250 Link Here
245
%%PORTDOCS%%share/tinker/test/diene.xyz
248
%%PORTDOCS%%share/tinker/test/diene.xyz
246
%%PORTDOCS%%share/tinker/test/dimethane.key
249
%%PORTDOCS%%share/tinker/test/dimethane.key
247
%%PORTDOCS%%share/tinker/test/dimethane.xyz
250
%%PORTDOCS%%share/tinker/test/dimethane.xyz
251
%%PORTDOCS%%share/tinker/test/diwater.key
252
%%PORTDOCS%%share/tinker/test/diwater.lin
253
%%PORTDOCS%%share/tinker/test/diwater.xyz
248
%%PORTDOCS%%share/tinker/test/enkephalin.int
254
%%PORTDOCS%%share/tinker/test/enkephalin.int
249
%%PORTDOCS%%share/tinker/test/enkephalin.key
255
%%PORTDOCS%%share/tinker/test/enkephalin.key
250
%%PORTDOCS%%share/tinker/test/enkephalin.make
256
%%PORTDOCS%%share/tinker/test/enkephalin.make
Lines 271-276 Link Here
271
%%PORTDOCS%%share/tinker/test/form.xyz
277
%%PORTDOCS%%share/tinker/test/form.xyz
272
%%PORTDOCS%%share/tinker/test/formbig.key
278
%%PORTDOCS%%share/tinker/test/formbig.key
273
%%PORTDOCS%%share/tinker/test/formbig.xyz
279
%%PORTDOCS%%share/tinker/test/formbig.xyz
280
%%PORTDOCS%%share/tinker/test/formbox.dyn
274
%%PORTDOCS%%share/tinker/test/formbox.key
281
%%PORTDOCS%%share/tinker/test/formbox.key
275
%%PORTDOCS%%share/tinker/test/formbox.xyz
282
%%PORTDOCS%%share/tinker/test/formbox.xyz
276
%%PORTDOCS%%share/tinker/test/furan.int
283
%%PORTDOCS%%share/tinker/test/furan.int
Lines 292-297 Link Here
292
%%PORTDOCS%%share/tinker/test/hexanes.key
299
%%PORTDOCS%%share/tinker/test/hexanes.key
293
%%PORTDOCS%%share/tinker/test/hexanes.run
300
%%PORTDOCS%%share/tinker/test/hexanes.run
294
%%PORTDOCS%%share/tinker/test/hexanes.xyz
301
%%PORTDOCS%%share/tinker/test/hexanes.xyz
302
%%PORTDOCS%%share/tinker/test/hexanex.xyz
295
%%PORTDOCS%%share/tinker/test/imidazole.int
303
%%PORTDOCS%%share/tinker/test/imidazole.int
296
%%PORTDOCS%%share/tinker/test/imidazole.key
304
%%PORTDOCS%%share/tinker/test/imidazole.key
297
%%PORTDOCS%%share/tinker/test/imidazole.xyz
305
%%PORTDOCS%%share/tinker/test/imidazole.xyz
Lines 300-309 Link Here
300
%%PORTDOCS%%share/tinker/test/imine.xyz
308
%%PORTDOCS%%share/tinker/test/imine.xyz
301
%%PORTDOCS%%share/tinker/test/lactam.key
309
%%PORTDOCS%%share/tinker/test/lactam.key
302
%%PORTDOCS%%share/tinker/test/lactam.xyz
310
%%PORTDOCS%%share/tinker/test/lactam.xyz
311
%%PORTDOCS%%share/tinker/test/lipid.key
312
%%PORTDOCS%%share/tinker/test/lipid.xyz
303
%%PORTDOCS%%share/tinker/test/melittin.key
313
%%PORTDOCS%%share/tinker/test/melittin.key
304
%%PORTDOCS%%share/tinker/test/melittin.pdb
314
%%PORTDOCS%%share/tinker/test/melittin.pdb
305
%%PORTDOCS%%share/tinker/test/melittin.seq
315
%%PORTDOCS%%share/tinker/test/melittin.seq
306
%%PORTDOCS%%share/tinker/test/melittin.xyz
316
%%PORTDOCS%%share/tinker/test/melittin.xyz
317
%%PORTDOCS%%share/tinker/test/membrane.key
318
%%PORTDOCS%%share/tinker/test/membrane.xyz
307
%%PORTDOCS%%share/tinker/test/methane.int
319
%%PORTDOCS%%share/tinker/test/methane.int
308
%%PORTDOCS%%share/tinker/test/methane.key
320
%%PORTDOCS%%share/tinker/test/methane.key
309
%%PORTDOCS%%share/tinker/test/methane.xyz
321
%%PORTDOCS%%share/tinker/test/methane.xyz
Lines 314-319 Link Here
314
%%PORTDOCS%%share/tinker/test/naphthalene.int
326
%%PORTDOCS%%share/tinker/test/naphthalene.int
315
%%PORTDOCS%%share/tinker/test/naphthalene.key
327
%%PORTDOCS%%share/tinker/test/naphthalene.key
316
%%PORTDOCS%%share/tinker/test/naphthalene.xyz
328
%%PORTDOCS%%share/tinker/test/naphthalene.xyz
329
%%PORTDOCS%%share/tinker/test/nitrogen.dyn
330
%%PORTDOCS%%share/tinker/test/nitrogen.key
331
%%PORTDOCS%%share/tinker/test/nitrogen.xyz
317
%%PORTDOCS%%share/tinker/test/nma.int
332
%%PORTDOCS%%share/tinker/test/nma.int
318
%%PORTDOCS%%share/tinker/test/nma.key
333
%%PORTDOCS%%share/tinker/test/nma.key
319
%%PORTDOCS%%share/tinker/test/nma.xyz
334
%%PORTDOCS%%share/tinker/test/nma.xyz
Lines 342-347 Link Here
342
%%PORTDOCS%%share/tinker/test/peptide.xyz
357
%%PORTDOCS%%share/tinker/test/peptide.xyz
343
%%PORTDOCS%%share/tinker/test/phenanth.key
358
%%PORTDOCS%%share/tinker/test/phenanth.key
344
%%PORTDOCS%%share/tinker/test/phenanth.xyz
359
%%PORTDOCS%%share/tinker/test/phenanth.xyz
360
%%PORTDOCS%%share/tinker/test/pol3.key
361
%%PORTDOCS%%share/tinker/test/pol3.xyz
345
%%PORTDOCS%%share/tinker/test/propane.key
362
%%PORTDOCS%%share/tinker/test/propane.key
346
%%PORTDOCS%%share/tinker/test/propane.ray
363
%%PORTDOCS%%share/tinker/test/propane.ray
347
%%PORTDOCS%%share/tinker/test/propane.xyz
364
%%PORTDOCS%%share/tinker/test/propane.xyz
Lines 358-363 Link Here
358
%%PORTDOCS%%share/tinker/test/pyrrole.xyz
375
%%PORTDOCS%%share/tinker/test/pyrrole.xyz
359
%%PORTDOCS%%share/tinker/test/retinoic.key
376
%%PORTDOCS%%share/tinker/test/retinoic.key
360
%%PORTDOCS%%share/tinker/test/retinoic.xyz
377
%%PORTDOCS%%share/tinker/test/retinoic.xyz
378
%%PORTDOCS%%share/tinker/test/skunk.key
379
%%PORTDOCS%%share/tinker/test/skunk.xyz
361
%%PORTDOCS%%share/tinker/test/sterol.key
380
%%PORTDOCS%%share/tinker/test/sterol.key
362
%%PORTDOCS%%share/tinker/test/sterol.xyz
381
%%PORTDOCS%%share/tinker/test/sterol.xyz
363
%%PORTDOCS%%share/tinker/test/styrene.int
382
%%PORTDOCS%%share/tinker/test/styrene.int
Lines 394-406 Link Here
394
%%PORTDOCS%%share/tinker/test/watersmall.dyn
413
%%PORTDOCS%%share/tinker/test/watersmall.dyn
395
%%PORTDOCS%%share/tinker/test/watersmall.key
414
%%PORTDOCS%%share/tinker/test/watersmall.key
396
%%PORTDOCS%%share/tinker/test/watersmall.xyz
415
%%PORTDOCS%%share/tinker/test/watersmall.xyz
416
%%PORTDOCS%%share/tinker/test/watertiny.dyn
417
%%PORTDOCS%%share/tinker/test/watertiny.key
418
%%PORTDOCS%%share/tinker/test/watertiny.xyz
397
%%PORTDOCS%%share/tinker/test/white.int
419
%%PORTDOCS%%share/tinker/test/white.int
398
%%PORTDOCS%%share/tinker/test/white.key
420
%%PORTDOCS%%share/tinker/test/white.key
399
%%PORTDOCS%%share/tinker/test/white.xyz
421
%%PORTDOCS%%share/tinker/test/white.xyz
400
%%PORTDOCS%%share/tinker/tinker.txt
422
share/tinker/tinker.txt
401
%%PORTDOCS%%@dirrm share/doc/tinker
423
%%PORTDOCS%%@dirrm share/doc/tinker
402
%%PORTDOCS%%@dirrm share/examples/tinker
424
%%PORTDOCS%%@dirrm share/examples/tinker
403
%%PORTDOCS%%@dirrm share/tinker/bench
425
%%PORTDOCS%%@dirrm share/tinker/bench
404
%%PORTDOCS%%@dirrm share/tinker/params
426
@dirrm share/tinker/params
405
%%PORTDOCS%%@dirrm share/tinker/test
427
%%PORTDOCS%%@dirrm share/tinker/test
406
%%PORTDOCS%%@dirrm share/tinker
428
@dirrm share/tinker
(-)tinker/pkg-plist.viewer (-24 / +46 lines)
Lines 14-19 Link Here
14
bin/minimize
14
bin/minimize
15
bin/minirot
15
bin/minirot
16
bin/minrigid
16
bin/minrigid
17
bin/monte
17
bin/newton
18
bin/newton
18
bin/newtrot
19
bin/newtrot
19
bin/nucleic
20
bin/nucleic
Lines 143-162 Link Here
143
%%PORTDOCS%%share/tinker/bench/results-3.7
144
%%PORTDOCS%%share/tinker/bench/results-3.7
144
%%PORTDOCS%%share/tinker/bench/results-3.8
145
%%PORTDOCS%%share/tinker/bench/results-3.8
145
%%PORTDOCS%%share/tinker/bench/results-3.9
146
%%PORTDOCS%%share/tinker/bench/results-3.9
146
%%PORTDOCS%%share/tinker/params/README
147
share/tinker/params/README
147
%%PORTDOCS%%share/tinker/params/amber.prm
148
share/tinker/params/amber.prm
148
%%PORTDOCS%%share/tinker/params/charmm.prm
149
share/tinker/params/charmm.prm
149
%%PORTDOCS%%share/tinker/params/dudek.prm
150
share/tinker/params/hoch.prm
150
%%PORTDOCS%%share/tinker/params/hoch.prm
151
share/tinker/params/mm2.prm
151
%%PORTDOCS%%share/tinker/params/mm2.prm
152
share/tinker/params/mm3.prm
152
%%PORTDOCS%%share/tinker/params/mm3.prm
153
share/tinker/params/mm3pro.prm
153
%%PORTDOCS%%share/tinker/params/mm3pro.prm
154
share/tinker/params/opls.prm
154
%%PORTDOCS%%share/tinker/params/opls.prm
155
share/tinker/params/oplsaa.prm
155
%%PORTDOCS%%share/tinker/params/oplsaa.prm
156
share/tinker/params/smooth.prm
156
%%PORTDOCS%%share/tinker/params/smooth.prm
157
share/tinker/params/smoothaa.prm
157
%%PORTDOCS%%share/tinker/params/smoothaa.prm
158
share/tinker/params/water.prm
158
%%PORTDOCS%%share/tinker/params/water.prm
159
share/tinker/rasmol/rasmol.hlp
159
%%PORTDOCS%%share/tinker/rasmol/rasmol.hlp
160
%%PORTDOCS%%share/tinker/test/README
160
%%PORTDOCS%%share/tinker/test/README
161
%%PORTDOCS%%share/tinker/test/ala20.key
161
%%PORTDOCS%%share/tinker/test/ala20.key
162
%%PORTDOCS%%share/tinker/test/ala20.xyz
162
%%PORTDOCS%%share/tinker/test/ala20.xyz
Lines 187-192 Link Here
187
%%PORTDOCS%%share/tinker/test/bowl2.xyz
187
%%PORTDOCS%%share/tinker/test/bowl2.xyz
188
%%PORTDOCS%%share/tinker/test/bowl3.key
188
%%PORTDOCS%%share/tinker/test/bowl3.key
189
%%PORTDOCS%%share/tinker/test/bowl3.xyz
189
%%PORTDOCS%%share/tinker/test/bowl3.xyz
190
%%PORTDOCS%%share/tinker/test/bucky.int
191
%%PORTDOCS%%share/tinker/test/bucky.key
192
%%PORTDOCS%%share/tinker/test/bucky.xyz
190
%%PORTDOCS%%share/tinker/test/butane.int
193
%%PORTDOCS%%share/tinker/test/butane.int
191
%%PORTDOCS%%share/tinker/test/butane.key
194
%%PORTDOCS%%share/tinker/test/butane.key
192
%%PORTDOCS%%share/tinker/test/butane.xyz
195
%%PORTDOCS%%share/tinker/test/butane.xyz
Lines 207-218 Link Here
207
%%PORTDOCS%%share/tinker/test/c5.key
210
%%PORTDOCS%%share/tinker/test/c5.key
208
%%PORTDOCS%%share/tinker/test/c5.seq
211
%%PORTDOCS%%share/tinker/test/c5.seq
209
%%PORTDOCS%%share/tinker/test/c5.xyz
212
%%PORTDOCS%%share/tinker/test/c5.xyz
210
%%PORTDOCS%%share/tinker/test/c7ax.key
213
%%PORTDOCS%%share/tinker/test/c7a.key
211
%%PORTDOCS%%share/tinker/test/c7ax.seq
214
%%PORTDOCS%%share/tinker/test/c7a.seq
212
%%PORTDOCS%%share/tinker/test/c7ax.xyz
215
%%PORTDOCS%%share/tinker/test/c7a.xyz
213
%%PORTDOCS%%share/tinker/test/c7eq.key
216
%%PORTDOCS%%share/tinker/test/c7e.key
214
%%PORTDOCS%%share/tinker/test/c7eq.seq
217
%%PORTDOCS%%share/tinker/test/c7e.seq
215
%%PORTDOCS%%share/tinker/test/c7eq.xyz
218
%%PORTDOCS%%share/tinker/test/c7e.xyz
216
%%PORTDOCS%%share/tinker/test/calmodulin.key
219
%%PORTDOCS%%share/tinker/test/calmodulin.key
217
%%PORTDOCS%%share/tinker/test/calmodulin.pdb
220
%%PORTDOCS%%share/tinker/test/calmodulin.pdb
218
%%PORTDOCS%%share/tinker/test/calmodulin.seq
221
%%PORTDOCS%%share/tinker/test/calmodulin.seq
Lines 250-255 Link Here
250
%%PORTDOCS%%share/tinker/test/diene.xyz
253
%%PORTDOCS%%share/tinker/test/diene.xyz
251
%%PORTDOCS%%share/tinker/test/dimethane.key
254
%%PORTDOCS%%share/tinker/test/dimethane.key
252
%%PORTDOCS%%share/tinker/test/dimethane.xyz
255
%%PORTDOCS%%share/tinker/test/dimethane.xyz
256
%%PORTDOCS%%share/tinker/test/diwater.key
257
%%PORTDOCS%%share/tinker/test/diwater.lin
258
%%PORTDOCS%%share/tinker/test/diwater.xyz
253
%%PORTDOCS%%share/tinker/test/enkephalin.int
259
%%PORTDOCS%%share/tinker/test/enkephalin.int
254
%%PORTDOCS%%share/tinker/test/enkephalin.key
260
%%PORTDOCS%%share/tinker/test/enkephalin.key
255
%%PORTDOCS%%share/tinker/test/enkephalin.make
261
%%PORTDOCS%%share/tinker/test/enkephalin.make
Lines 276-281 Link Here
276
%%PORTDOCS%%share/tinker/test/form.xyz
282
%%PORTDOCS%%share/tinker/test/form.xyz
277
%%PORTDOCS%%share/tinker/test/formbig.key
283
%%PORTDOCS%%share/tinker/test/formbig.key
278
%%PORTDOCS%%share/tinker/test/formbig.xyz
284
%%PORTDOCS%%share/tinker/test/formbig.xyz
285
%%PORTDOCS%%share/tinker/test/formbox.dyn
279
%%PORTDOCS%%share/tinker/test/formbox.key
286
%%PORTDOCS%%share/tinker/test/formbox.key
280
%%PORTDOCS%%share/tinker/test/formbox.xyz
287
%%PORTDOCS%%share/tinker/test/formbox.xyz
281
%%PORTDOCS%%share/tinker/test/furan.int
288
%%PORTDOCS%%share/tinker/test/furan.int
Lines 297-302 Link Here
297
%%PORTDOCS%%share/tinker/test/hexanes.key
304
%%PORTDOCS%%share/tinker/test/hexanes.key
298
%%PORTDOCS%%share/tinker/test/hexanes.run
305
%%PORTDOCS%%share/tinker/test/hexanes.run
299
%%PORTDOCS%%share/tinker/test/hexanes.xyz
306
%%PORTDOCS%%share/tinker/test/hexanes.xyz
307
%%PORTDOCS%%share/tinker/test/hexanex.xyz
300
%%PORTDOCS%%share/tinker/test/imidazole.int
308
%%PORTDOCS%%share/tinker/test/imidazole.int
301
%%PORTDOCS%%share/tinker/test/imidazole.key
309
%%PORTDOCS%%share/tinker/test/imidazole.key
302
%%PORTDOCS%%share/tinker/test/imidazole.xyz
310
%%PORTDOCS%%share/tinker/test/imidazole.xyz
Lines 305-314 Link Here
305
%%PORTDOCS%%share/tinker/test/imine.xyz
313
%%PORTDOCS%%share/tinker/test/imine.xyz
306
%%PORTDOCS%%share/tinker/test/lactam.key
314
%%PORTDOCS%%share/tinker/test/lactam.key
307
%%PORTDOCS%%share/tinker/test/lactam.xyz
315
%%PORTDOCS%%share/tinker/test/lactam.xyz
316
%%PORTDOCS%%share/tinker/test/lipid.key
317
%%PORTDOCS%%share/tinker/test/lipid.xyz
308
%%PORTDOCS%%share/tinker/test/melittin.key
318
%%PORTDOCS%%share/tinker/test/melittin.key
309
%%PORTDOCS%%share/tinker/test/melittin.pdb
319
%%PORTDOCS%%share/tinker/test/melittin.pdb
310
%%PORTDOCS%%share/tinker/test/melittin.seq
320
%%PORTDOCS%%share/tinker/test/melittin.seq
311
%%PORTDOCS%%share/tinker/test/melittin.xyz
321
%%PORTDOCS%%share/tinker/test/melittin.xyz
322
%%PORTDOCS%%share/tinker/test/membrane.key
323
%%PORTDOCS%%share/tinker/test/membrane.xyz
312
%%PORTDOCS%%share/tinker/test/methane.int
324
%%PORTDOCS%%share/tinker/test/methane.int
313
%%PORTDOCS%%share/tinker/test/methane.key
325
%%PORTDOCS%%share/tinker/test/methane.key
314
%%PORTDOCS%%share/tinker/test/methane.xyz
326
%%PORTDOCS%%share/tinker/test/methane.xyz
Lines 319-324 Link Here
319
%%PORTDOCS%%share/tinker/test/naphthalene.int
331
%%PORTDOCS%%share/tinker/test/naphthalene.int
320
%%PORTDOCS%%share/tinker/test/naphthalene.key
332
%%PORTDOCS%%share/tinker/test/naphthalene.key
321
%%PORTDOCS%%share/tinker/test/naphthalene.xyz
333
%%PORTDOCS%%share/tinker/test/naphthalene.xyz
334
%%PORTDOCS%%share/tinker/test/nitrogen.dyn
335
%%PORTDOCS%%share/tinker/test/nitrogen.key
336
%%PORTDOCS%%share/tinker/test/nitrogen.xyz
322
%%PORTDOCS%%share/tinker/test/nma.int
337
%%PORTDOCS%%share/tinker/test/nma.int
323
%%PORTDOCS%%share/tinker/test/nma.key
338
%%PORTDOCS%%share/tinker/test/nma.key
324
%%PORTDOCS%%share/tinker/test/nma.xyz
339
%%PORTDOCS%%share/tinker/test/nma.xyz
Lines 347-352 Link Here
347
%%PORTDOCS%%share/tinker/test/peptide.xyz
362
%%PORTDOCS%%share/tinker/test/peptide.xyz
348
%%PORTDOCS%%share/tinker/test/phenanth.key
363
%%PORTDOCS%%share/tinker/test/phenanth.key
349
%%PORTDOCS%%share/tinker/test/phenanth.xyz
364
%%PORTDOCS%%share/tinker/test/phenanth.xyz
365
%%PORTDOCS%%share/tinker/test/pol3.key
366
%%PORTDOCS%%share/tinker/test/pol3.xyz
350
%%PORTDOCS%%share/tinker/test/propane.key
367
%%PORTDOCS%%share/tinker/test/propane.key
351
%%PORTDOCS%%share/tinker/test/propane.ray
368
%%PORTDOCS%%share/tinker/test/propane.ray
352
%%PORTDOCS%%share/tinker/test/propane.xyz
369
%%PORTDOCS%%share/tinker/test/propane.xyz
Lines 363-368 Link Here
363
%%PORTDOCS%%share/tinker/test/pyrrole.xyz
380
%%PORTDOCS%%share/tinker/test/pyrrole.xyz
364
%%PORTDOCS%%share/tinker/test/retinoic.key
381
%%PORTDOCS%%share/tinker/test/retinoic.key
365
%%PORTDOCS%%share/tinker/test/retinoic.xyz
382
%%PORTDOCS%%share/tinker/test/retinoic.xyz
383
%%PORTDOCS%%share/tinker/test/skunk.key
384
%%PORTDOCS%%share/tinker/test/skunk.xyz
366
%%PORTDOCS%%share/tinker/test/sterol.key
385
%%PORTDOCS%%share/tinker/test/sterol.key
367
%%PORTDOCS%%share/tinker/test/sterol.xyz
386
%%PORTDOCS%%share/tinker/test/sterol.xyz
368
%%PORTDOCS%%share/tinker/test/styrene.int
387
%%PORTDOCS%%share/tinker/test/styrene.int
Lines 399-412 Link Here
399
%%PORTDOCS%%share/tinker/test/watersmall.dyn
418
%%PORTDOCS%%share/tinker/test/watersmall.dyn
400
%%PORTDOCS%%share/tinker/test/watersmall.key
419
%%PORTDOCS%%share/tinker/test/watersmall.key
401
%%PORTDOCS%%share/tinker/test/watersmall.xyz
420
%%PORTDOCS%%share/tinker/test/watersmall.xyz
421
%%PORTDOCS%%share/tinker/test/watertiny.dyn
422
%%PORTDOCS%%share/tinker/test/watertiny.key
423
%%PORTDOCS%%share/tinker/test/watertiny.xyz
402
%%PORTDOCS%%share/tinker/test/white.int
424
%%PORTDOCS%%share/tinker/test/white.int
403
%%PORTDOCS%%share/tinker/test/white.key
425
%%PORTDOCS%%share/tinker/test/white.key
404
%%PORTDOCS%%share/tinker/test/white.xyz
426
%%PORTDOCS%%share/tinker/test/white.xyz
405
%%PORTDOCS%%share/tinker/tinker.txt
427
share/tinker/tinker.txt
406
%%PORTDOCS%%@dirrm share/doc/tinker
428
%%PORTDOCS%%@dirrm share/doc/tinker
407
%%PORTDOCS%%@dirrm share/examples/tinker
429
%%PORTDOCS%%@dirrm share/examples/tinker
408
%%PORTDOCS%%@dirrm share/tinker/bench
430
%%PORTDOCS%%@dirrm share/tinker/bench
409
%%PORTDOCS%%@dirrm share/tinker/params
431
@dirrm share/tinker/params
410
%%PORTDOCS%%@dirrm share/tinker/rasmol
432
@dirrm share/tinker/rasmol
411
%%PORTDOCS%%@dirrm share/tinker/test
433
%%PORTDOCS%%@dirrm share/tinker/test
412
%%PORTDOCS%%@dirrm share/tinker
434
@dirrm share/tinker

Return to bug 33425