[MacPorts] #10426: Gromacs 3.3.1 Update

[MacPorts]

#10426: Gromacs 3.3.1 Update
--------------------------+-----------------------
  Reporter:  ephemeron@…  |      Owner:  gwright@…
      Type:  update       |     Status:  closed
  Priority:  Normal       |  Milestone:
 Component:  ports        |    Version:  1.2
Resolution:  fixed        |   Keywords:
      Port:  gromacs      |
--------------------------+-----------------------
Changes (by ryandesign@…):

 * type:  defect => update
 * port:   => gromacs


Old description:

> Updated to gromacs 3.3.1.  Tested on G5 Dual-2.0ghz. It seems to require
> /opt/local/lib/gromacs/bin be added to the path for the binaries to be
> accessible, is that normal?  I didn't change anything relevant to that in
> the Portfile.
>
> Here's the Portfile diff:
>
> --- Portfile.old        2004-12-02 22:41:11.000000000 -0500
> +++ Portfile    2006-08-15 14:37:38.000000000 -0400
> @@ -1,8 +1,8 @@
>  # $Id: Portfile,v 1.10 2004/12/03 03:41:11 gwright Exp $
>
>  PortSystem 1.0
> -name           gromacs
> -version                3.1.5_pre1
> +name   gromacs
> +version        3.3.1
>  revision       0
>  categories     science math
>  maintainers    darwinports at opendarwin.org
> @@ -16,9 +16,9 @@
>         usually dominate simulations) many groups are also using it for \
>         research on non-biological systems, e.g. polymers.
>  platforms      darwin
> -master_sites   ftp://ftp.gromacs.org/pub/beta/
> -checksums      md5 edfca24da79d0e89eb34548098909fd3
> -depends_lib    lib:sfftw:fftw-single
> +master_sites   ftp://ftp.gromacs.org/pub/gromacs/
> +checksums      md5 1af34a99950813ca7cf893253c447cd1
> +depends_lib    lib:sfftw-3:fftw-3-single
>  configure.env  LDFLAGS="-L${prefix}/lib" \
>                 CPPFLAGS="-I${prefix}/include"

New description:

 Updated to gromacs 3.3.1.  Tested on G5 Dual-2.0ghz. It seems to require
 /opt/local/lib/gromacs/bin be added to the path for the binaries to be
 accessible, is that normal?  I didn't change anything relevant to that in
 the Portfile.

 Here's the Portfile diff:

 {{{
 --- Portfile.old        2004-12-02 22:41:11.000000000 -0500
 +++ Portfile    2006-08-15 14:37:38.000000000 -0400
 @@ -1,8 +1,8 @@
  # $Id: Portfile,v 1.10 2004/12/03 03:41:11 gwright Exp $

  PortSystem 1.0
 -name           gromacs
 -version                3.1.5_pre1
 +name   gromacs
 +version        3.3.1
  revision       0
  categories     science math
  maintainers    darwinports at opendarwin.org
 @@ -16,9 +16,9 @@
         usually dominate simulations) many groups are also using it for \
         research on non-biological systems, e.g. polymers.
  platforms      darwin
 -master_sites   ftp://ftp.gromacs.org/pub/beta/
 -checksums      md5 edfca24da79d0e89eb34548098909fd3
 -depends_lib    lib:sfftw:fftw-single
 +master_sites   ftp://ftp.gromacs.org/pub/gromacs/
 +checksums      md5 1af34a99950813ca7cf893253c447cd1
 +depends_lib    lib:sfftw-3:fftw-3-single
  configure.env  LDFLAGS="-L${prefix}/lib" \
                 CPPFLAGS="-I${prefix}/include"
 }}}

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Ticket URL: <https://trac.macports.org/ticket/10426#comment:4>
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