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* coorect previos use flag changeCarsten Lohrke2005-12-231-3/+3
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* coorect previos use flag changeCarsten Lohrke2005-12-233-6/+6
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* Use global jpeg2k use flag.Carsten Lohrke2005-12-231-14/+4
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* Use global jpeg2k use flag.Carsten Lohrke2005-12-234-16/+20
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* Libraries needed to build the other RCSB Protein Data Bank tools.Donnie Berkholz2005-12-201-3/+3
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* Libraries needed to build the other RCSB Protein Data Bank tools.Donnie Berkholz2005-12-206-0/+365
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* Part of the RCSB Protein Data Bank tools. Provides the data necessary to run ↵Donnie Berkholz2005-12-201-4/+3
| | | | | | | the other applications. (Portage version: 2.1_pre1) (Unsigned Manifest commit)
* Part of the RCSB Protein Data Bank tools. Provides the data necessary to run ↵Donnie Berkholz2005-12-206-0/+98
| | | | | | the other applications. (Portage version: 2.1_pre1)
* Use python eclass functions to determine installed python version.Markus Dittrich2005-12-191-2/+2
| | | | | (Portage version: 2.0.51.22-r3) (Unsigned Manifest commit)
* Use python eclass functions to determine installed python version.Markus Dittrich2005-12-193-16/+11
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* Fixed compilation problems when using cmake-2.2.x and when compiling against ↵Markus Dittrich2005-12-181-2/+2
| | | | | | | python 2.4.x. Also corrected installation path of vtk jar file. This fixes bugs #112119, #103343, #113597. (Portage version: 2.0.51.22-r3) (Unsigned Manifest commit)
* Fixed compilation problems when using cmake-2.2.x and when compiling against ↵Markus Dittrich2005-12-183-18/+32
| | | | | | python 2.4.x. Also corrected installation path of vtk jar file. This fixes bugs #112119, #103343, #113597. (Portage version: 2.0.51.22-r3)
* Remove --with-gnu-ld option, bug #108386.Diego Elio Pettenò2005-12-162-0/+20
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* Remove --with-gnu-ld option, bug #108386.Diego Elio Pettenò2005-12-162-6/+6
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* Remove --with-gnu-ld option, bug #108386.Diego Elio Pettenò2005-12-164-6/+12
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* A Fortran- or C-callable, device-independent graphics package for making ↵Donnie Berkholz2005-12-161-1/+3
| | | | | | | simple scientific graphs. (Portage version: 2.0.53) (Unsigned Manifest commit)
* A Fortran- or C-callable, device-independent graphics package for making ↵Donnie Berkholz2005-12-168-0/+242
| | | | | | simple scientific graphs. (Portage version: 2.0.53)
* Replace -Os with -O2, closes bug 112741.Marcus D. Hanwell2005-12-141-0/+10
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* Replace -Os with -O2, closes bug 112741.Marcus D. Hanwell2005-12-141-4/+4
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* Replace -Os with -O2, closes bug 112741.Marcus D. Hanwell2005-12-142-2/+7
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* Marked ~amd64Daniel Gryniewicz2005-12-132-0/+20
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* Marked ~amd64Daniel Gryniewicz2005-12-132-4/+4
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* Marked ~amd64Daniel Gryniewicz2005-12-136-25/+21
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* New library, used to evaluate integrals over Cartesian Gaussian functions. ↵Donnie Berkholz2005-12-061-1/+3
| | | | | | | Useful in quantum chemistry. Is autodetected by sci-chemistry/mpqc now and used for very advanced methods, but hopefully will be able to fix that behavior soon. (Portage version: 2.0.53) (Unsigned Manifest commit)
* New library, used to evaluate integrals over Cartesian Gaussian functions. ↵Donnie Berkholz2005-12-066-0/+81
| | | | | | Useful in quantum chemistry. Is autodetected by sci-chemistry/mpqc now and used for very advanced methods, but hopefully will be able to fix that behavior soon. (Portage version: 2.0.53)
* Bump. Remove faulty libf2c dep; block on mpqc-2.3, pending upstream bug ↵Donnie Berkholz2005-12-061-1/+3
| | | | | | | #237; Change openbabel dep to =1*, pending upstream bug #238; Add needed deps on virtual/blas and virtual/lapack. (Portage version: 2.0.53) (Unsigned Manifest commit)
* Bump. Remove faulty libf2c dep; block on mpqc-2.3, pending upstream bug ↵Donnie Berkholz2005-12-063-1/+50
| | | | | | #237; Change openbabel dep to =1*, pending upstream bug #238; Add needed deps on virtual/blas and virtual/lapack. (Portage version: 2.0.53)
* fix changelog headerSven Wegener2005-12-051-1/+1
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* fix changelog headerSven Wegener2005-12-051-2/+2
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* fix invalid atomsSven Wegener2005-12-051-3/+3
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* fix invalid atomsSven Wegener2005-12-053-6/+6
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* Fixes for bugs 111688 and 113480.Steve Arnold2005-12-031-5/+6
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* Fixes for bugs 111688 and 113480.Steve Arnold2005-12-035-12/+45
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* Move from sci-chemistry.Donnie Berkholz2005-12-021-3/+3
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* Move from sci-chemistry.Donnie Berkholz2005-12-025-0/+62
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* Fixed bad digest for source tarball. This closes bug #113850.Markus Dittrich2005-11-291-1/+1
| | | | | (Portage version: 2.0.51.22-r3) (Unsigned Manifest commit)
* Fixed bad digest for source tarball. This closes bug #113850.Markus Dittrich2005-11-293-3/+7
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* Switched from perl-module to perl-app eclassMichael Cummings2005-11-281-0/+10
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* Switched from perl-module to perl-app eclassMichael Cummings2005-11-281-9/+9
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* Switched from perl-module to perl-app eclassMichael Cummings2005-11-284-9/+12
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* Initial import (fixes bug #102323).Markus Dittrich2005-11-271-1/+3
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* Initial import (fixes bug #102323).Markus Dittrich2005-11-275-0/+78
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* fixed small typo in nameMarkus Dittrich2005-11-251-1/+1
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* fixed small typo in nameMarkus Dittrich2005-11-251-2/+2
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* Initial import (fixes bug #45678 ).Markus Dittrich2005-11-241-2/+2
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* Initial import (fixes bug #45678 ).Markus Dittrich2005-11-245-0/+62
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* stable on amd64; bug 98593Simon Stelling2005-11-211-5/+5
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* stable on amd64; bug 98593Simon Stelling2005-11-212-3/+9
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* stable on amd64Simon Stelling2005-11-211-5/+5
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* stable on amd64Simon Stelling2005-11-212-3/+6
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