[gentoo-commits] gentoo-x86 commit in sci-chemistry/ccp4i/files: 6.1.3-rename-superpose.patch 6.1.3-rename-rapper.patch 6.1.3-rename-truncate.patch

[Justin Lecher (jlec)]

jlec        10/04/25 12:32:54

  Modified:             6.1.3-rename-superpose.patch
                        6.1.3-rename-rapper.patch
                        6.1.3-rename-truncate.patch
  Log:
  Fixes missing renames, thanks Johan Hattne for giving the patches, #314053
  (Portage version: 2.2_rc67/cvs/Linux x86_64)

Revision  Changes    Path
1.2                  sci-chemistry/ccp4i/files/6.1.3-rename-superpose.patch

file : http://sources.gentoo.org/viewcvs.py/gentoo-x86/sci-chemistry/ccp4i/files/6.1.3-rename-superpose.patch?rev=1.2&view=markup
plain: http://sources.gentoo.org/viewcvs.py/gentoo-x86/sci-chemistry/ccp4i/files/6.1.3-rename-superpose.patch?rev=1.2&content-type=text/plain
diff : http://sources.gentoo.org/viewcvs.py/gentoo-x86/sci-chemistry/ccp4i/files/6.1.3-rename-superpose.patch?r1=1.1&r2=1.2

Index: 6.1.3-rename-superpose.patch
===================================================================
RCS file: /var/cvsroot/gentoo-x86/sci-chemistry/ccp4i/files/6.1.3-rename-superpose.patch,v
retrieving revision 1.1
retrieving revision 1.2
diff -u -r1.1 -r1.2
--- 6.1.3-rename-superpose.patch	6 Feb 2010 00:24:32 -0000	1.1
+++ 6.1.3-rename-superpose.patch	25 Apr 2010 12:32:54 -0000	1.2
@@ -1,6 +1,7 @@
-diff -arNu ccp4-6.1.1/ccp4i/scripts/superpose.script ccp4-6.1.1.new/ccp4i/scripts/superpose.script
---- ccp4-6.1.1/ccp4i/scripts/superpose.script	2006-07-26 16:22:49.000000000 +0200
-+++ ccp4-6.1.1.new/ccp4i/scripts/superpose.script	2009-07-05 22:11:59.000000000 +0200
+diff --git a/ccp4i/scripts/superpose.script b/ccp4i/scripts/superpose.script
+index 3483c97..5027536 100755
+--- a/ccp4i/scripts/superpose.script
++++ b/ccp4i/scripts/superpose.script
 @@ -21,7 +21,7 @@
  
    if { [regexp SSM $SUPERPOSE_MODE ] } {
@@ -10,3 +11,16 @@
      set status [Execute $cmd "" program_status report ]
  
    } elseif { [regexp TOP $SUPERPOSE_MODE ] } {
+diff --git a/ccp4i/tasks/superpose.tcl b/ccp4i/tasks/superpose.tcl
+index 748bf6e..c92122a 100755
+--- a/ccp4i/tasks/superpose.tcl
++++ b/ccp4i/tasks/superpose.tcl
+@@ -100,7 +100,7 @@ proc superpose_run { arrayname } {
+ # If user is match equivalent named residues/atoms then fit in the match fields
+   switch [GetValue $arrayname SUPERPOSE_MODE] \
+   SSM {
+-    if { ![file exists [FindExecutable superpose]] } {
++    if { ![file exists [FindExecutable superpose-ccp4]] } {
+        WarningMessage "The program \"superpose\" is not on your path. 
+ Check your installation for \"superpose\" program and \"ssm\" library."
+        return 0



1.2                  sci-chemistry/ccp4i/files/6.1.3-rename-rapper.patch

file : http://sources.gentoo.org/viewcvs.py/gentoo-x86/sci-chemistry/ccp4i/files/6.1.3-rename-rapper.patch?rev=1.2&view=markup
plain: http://sources.gentoo.org/viewcvs.py/gentoo-x86/sci-chemistry/ccp4i/files/6.1.3-rename-rapper.patch?rev=1.2&content-type=text/plain
diff : http://sources.gentoo.org/viewcvs.py/gentoo-x86/sci-chemistry/ccp4i/files/6.1.3-rename-rapper.patch?r1=1.1&r2=1.2

Index: 6.1.3-rename-rapper.patch
===================================================================
RCS file: /var/cvsroot/gentoo-x86/sci-chemistry/ccp4i/files/6.1.3-rename-rapper.patch,v
retrieving revision 1.1
retrieving revision 1.2
diff -u -r1.1 -r1.2
--- 6.1.3-rename-rapper.patch	6 Feb 2010 00:24:32 -0000	1.1
+++ 6.1.3-rename-rapper.patch	25 Apr 2010 12:32:54 -0000	1.2
@@ -1,5 +1,20 @@
---- ccp4i/scripts/rapper.script 2009-02-03 11:49:50.000000000 +0100
-+++ ccp4i/scripts/rapper.script.new     2009-03-12 23:34:47.000000000 +0100
+diff --git a/ccp4i/scripts/check.script b/ccp4i/scripts/check.script
+index def44bc..dd4bb7e 100755
+--- a/ccp4i/scripts/check.script
++++ b/ccp4i/scripts/check.script
+@@ -24,7 +24,7 @@
+   if $RUN_RAMPAGE {
+ 
+     # Generate command line
+-    set cmd "[BinPath rapper]"
++    set cmd "[BinPath rappermc]"
+ 
+     set rapperdatadir [FileJoin [GetEnvPath CCP4] share rapper]
+     set paramsfile [FileJoin $rapperdatadir params.xml]
+diff --git a/ccp4i/scripts/rapper.script b/ccp4i/scripts/rapper.script
+index cdae1e2..faae226 100755
+--- a/ccp4i/scripts/rapper.script
++++ b/ccp4i/scripts/rapper.script
 @@ -17,7 +17,7 @@
  
  #set up command line 
@@ -9,4 +24,38 @@
  
  set rapperdatadir [FileJoin [GetEnvPath CCP4] share rapper]
  set paramsfile [FileJoin [GetEnvPath CCP4] share rapper params.xml]
-
+@@ -180,7 +180,7 @@ append outfiles " $XYZOUT PROJECT"
+ 
+ # Run RAPPER to join loop back to framework and out put to defined pdb file
+ # Also need to sort out multimodel files join - FIX ME
+-set cmd2 "[BinPath rapper]"
++set cmd2 "[BinPath rappermc]"
+ append cmd2 " $paramsfile joinpdb "
+ append cmd2 " --pdb2 \"$root\-loop.pdb\" "
+ append cmd2 " --pdb  \"$root\-framework.pdb\" "
+diff --git a/ccp4i/tasks/check.tcl b/ccp4i/tasks/check.tcl
+index ae88ff2..ee3307b 100755
+--- a/ccp4i/tasks/check.tcl
++++ b/ccp4i/tasks/check.tcl
+@@ -46,7 +46,7 @@ proc check_run { arrayname } {
+  # Check for Rampage program. If it is not found, we switch off the option.
+  # If it was the only option, script will fail with next check.
+  if { $array(RUN_RAMPAGE) == 1 } {
+-   if { [FindExecutable "rapper"] == "" } {
++   if { [FindExecutable "rappermc"] == "" } {
+       WarningMessage "Input Error: Rapper_Rampage program not found in system path."
+       set array(RUN_RAMPAGE) 0
+     }
+diff --git a/ccp4i/tasks/rapper.tcl b/ccp4i/tasks/rapper.tcl
+index e299057..8843a3f 100755
+--- a/ccp4i/tasks/rapper.tcl
++++ b/ccp4i/tasks/rapper.tcl
+@@ -28,7 +28,7 @@ proc rapper_run { arrayname } {
+  # Check for RAPPER program. If it is not found, we switch off the option.
+  # If it was the only option, script will fail with next check.
+   if { [regexp MODEL $build_type ] && $prog_type == "RAPPER"} {
+-   if { [FindExecutable "rapper"] == "" } {
++   if { [FindExecutable "rappermc"] == "" } {
+       WarningMessage "Input Error: RAPPER program not found in system path."
+       set build_type 0
+     }



1.2                  sci-chemistry/ccp4i/files/6.1.3-rename-truncate.patch

file : http://sources.gentoo.org/viewcvs.py/gentoo-x86/sci-chemistry/ccp4i/files/6.1.3-rename-truncate.patch?rev=1.2&view=markup
plain: http://sources.gentoo.org/viewcvs.py/gentoo-x86/sci-chemistry/ccp4i/files/6.1.3-rename-truncate.patch?rev=1.2&content-type=text/plain
diff : http://sources.gentoo.org/viewcvs.py/gentoo-x86/sci-chemistry/ccp4i/files/6.1.3-rename-truncate.patch?r1=1.1&r2=1.2

Index: 6.1.3-rename-truncate.patch
===================================================================
RCS file: /var/cvsroot/gentoo-x86/sci-chemistry/ccp4i/files/6.1.3-rename-truncate.patch,v
retrieving revision 1.1
retrieving revision 1.2
diff -u -r1.1 -r1.2
--- 6.1.3-rename-truncate.patch	6 Feb 2010 00:24:32 -0000	1.1
+++ 6.1.3-rename-truncate.patch	25 Apr 2010 12:32:54 -0000	1.2
@@ -1,16 +1,85 @@
---- ./ccp4i/templates/truncate.com.orig	2009-03-02 23:31:04.000000000 -0800
-+++ ./ccp4i/templates/truncate.com	2009-03-02 23:31:08.000000000 -0800
-@@ -11,7 +11,7 @@
- $SYMMETRY symmetry $SPACE_GROUP
- $CELL cell $CELL_1 $CELL_2 $CELL_3 $CELL_4 $CELL_5 $CELL_6
- 
--1 truncate
-+1 ftruncate
-  - { [StringSame $APPLY_TRUNCATE "WILSON" ] } YES | NO
- {[IfSet $ANOMALOUS]} anomalous 
-  - $ANOMALOUS YES | NO
---- ./ccp4i/scripts/truncate.script.orig	2009-03-02 23:39:04.000000000 -0800
-+++ ./ccp4i/scripts/truncate.script	2009-03-02 23:39:41.000000000 -0800
+diff --git a/ccp4i/crank/plugins/prep/crank_prep.tcl b/ccp4i/crank/plugins/prep/crank_prep.tcl
+index 7d05905..d01f1dc 100755
+--- a/ccp4i/crank/plugins/prep/crank_prep.tcl
++++ b/ccp4i/crank/plugins/prep/crank_prep.tcl
+@@ -226,7 +226,7 @@ proc run_truncate { i j } {
+     set script "$script\n$labout"
+     set script "$script\nEND\n"
+ 	
+-    set run_command "truncate $command << \"$script\""
++    set run_command "ftruncate $command << \"$script\""
+     puts $run_command
+     catch {eval exec $run_command } output 
+     puts $output
+diff --git a/ccp4i/scripts/dtrek2mtz.script b/ccp4i/scripts/dtrek2mtz.script
+index e74aa0d..a2a1adb 100755
+--- a/ccp4i/scripts/dtrek2mtz.script
++++ b/ccp4i/scripts/dtrek2mtz.script
+@@ -36,7 +36,7 @@
+     set HKL_TRUNCATE [GetTmpFileName -ext mtz]
+ 
+     CreateComScript truncate truncate_script
+-    set cmd "[BinPath truncate] HKLIN \"$HKLTMP\" HKLOUT \"$HKL_TRUNCATE\""
++    set cmd "[BinPath ftruncate] HKLIN \"$HKLTMP\" HKLOUT \"$HKL_TRUNCATE\""
+     set status [Execute $cmd $truncate_script program_status report]
+ 
+     HandleHarvestFile $HARVEST_MODE $HARVEST_PNAME $HARVEST_DNAME truncate
+diff --git a/ccp4i/scripts/import.script b/ccp4i/scripts/import.script
+index 90cba83..1c90c33 100755
+--- a/ccp4i/scripts/import.script
++++ b/ccp4i/scripts/import.script
+@@ -144,7 +144,7 @@ if { $FORMAT ==  "MTZ" } {
+ 
+     set truncatemtz [GetTmpFileName -ext mtz ]
+     CreateComScript truncate truncate_script
+-    set cmd "[BinPath truncate] HKLIN \"$tmpmtz\" HKLOUT \"$truncatemtz\""
++    set cmd "[BinPath ftruncate] HKLIN \"$tmpmtz\" HKLOUT \"$truncatemtz\""
+     set status [Execute $cmd $truncate_script program_status report]
+ 
+ 
+diff --git a/ccp4i/scripts/import_scaled.script b/ccp4i/scripts/import_scaled.script
+index dcc619b..7250513 100755
+--- a/ccp4i/scripts/import_scaled.script
++++ b/ccp4i/scripts/import_scaled.script
+@@ -62,7 +62,7 @@
+ 
+     } else {
+       CreateComScript truncate truncate_script
+-      set cmd "[BinPath truncate] HKLIN \"$HKLTMP\" HKLOUT \"$HKL_TRUNCATE\""
++      set cmd "[BinPath ftruncate] HKLIN \"$HKLTMP\" HKLOUT \"$HKL_TRUNCATE\""
+       set status [Execute $cmd $truncate_script program_status report]
+ 
+       HandleHarvestFile $HARVEST_MODE $HARVEST_PNAME $HARVEST_DNAME truncate
+diff --git a/ccp4i/scripts/scala.script b/ccp4i/scripts/scala.script
+index 6940ccd..bde10d6 100755
+--- a/ccp4i/scripts/scala.script
++++ b/ccp4i/scripts/scala.script
+@@ -275,7 +275,7 @@ END"
+ 
+       } else {
+         CreateComScript truncate truncate_script
+-        set cmd "[BinPath truncate] HKLIN \"$HKLTMP\" HKLOUT \"$HKL_TRUNCATE\""  
++        set cmd "[BinPath ftruncate] HKLIN \"$HKLTMP\" HKLOUT \"$HKL_TRUNCATE\""  
+         set status [Execute $cmd $truncate_script $LOG_FILE  program_status report  ]
+       }
+           
+diff --git a/ccp4i/scripts/scalepack2mtz.script b/ccp4i/scripts/scalepack2mtz.script
+index 986e06c..a1947a6 100755
+--- a/ccp4i/scripts/scalepack2mtz.script
++++ b/ccp4i/scripts/scalepack2mtz.script
+@@ -35,7 +35,7 @@
+ 
+     set HKL_TRUNCATE [GetTmpFileName -ext mtz]
+     CreateComScript truncate truncate_script
+-    set cmd "[BinPath truncate] HKLIN \"$HKLTMP\" HKLOUT \"$HKL_TRUNCATE\""
++    set cmd "[BinPath ftruncate] HKLIN \"$HKLTMP\" HKLOUT \"$HKL_TRUNCATE\""
+     set status [Execute $cmd $truncate_script program_status report]
+ 
+     HandleHarvestFile $HARVEST_MODE $HARVEST_PNAME $HARVEST_DNAME truncate
+diff --git a/ccp4i/scripts/truncate.script b/ccp4i/scripts/truncate.script
+index e0e09ce..2d448a2 100755
+--- a/ccp4i/scripts/truncate.script
++++ b/ccp4i/scripts/truncate.script
 @@ -45,7 +45,7 @@
  
    CreateComScript truncate truncate_script