metadata.xml 1.2 KB

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  1. <?xml version="1.0" encoding="UTF-8"?>
  2. <!DOCTYPE pkgmetadata SYSTEM "http://www.gentoo.org/dtd/metadata.dtd">
  3. <pkgmetadata>
  4. <maintainer type="person">
  5. <email>junghans@gentoo.org</email>
  6. <name>Christoph Junghans</name>
  7. </maintainer>
  8. <maintainer type="person">
  9. <email>alexxy@gentoo.org</email>
  10. <name>Alexey Shvetsov</name>
  11. </maintainer>
  12. <maintainer type="project">
  13. <email>sci-chemistry@gentoo.org</email>
  14. <name>Gentoo Chemistry Project</name>
  15. </maintainer>
  16. <use>
  17. <flag name="cuda">Enable cuda non-bonded kernels</flag>
  18. <flag name="double-precision">More precise calculations at the expense of speed</flag>
  19. <flag name="single-precision">Single precision version of gromacs (default)</flag>
  20. <flag name="boost">Enable external boost library</flag>
  21. <flag name="hwloc">Enable HWLoc lib support</flag>
  22. <flag name="tng">Enable new trajectory format - tng</flag>
  23. <flag name="make-symlinks">Create symbolic links for pre-5.0 binary names</flag>
  24. <!-- acceleration optimization flags -->
  25. <flag name="offensive">Enable gromacs partly offensive quotes</flag>
  26. <flag name="mkl">Use <pkg>sci-libs/mkl</pkg> for fft, blas, lapack routines</flag>
  27. </use>
  28. </pkgmetadata>