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Port details
pcmsolver API for the Polarizable Continuum Model
1.1.11 science on this many watch lists=0 search for ports that depend on this port Find issues related to this port Report an issue related to this port
Maintainer: yuri@FreeBSD.org search for ports maintained by this maintainer
Port Added: 14 Nov 2017 18:05:52
License: GPLv3
PCMSolver is a quantum chemistry library that aims to:
* Provide a plug-and-play library for adding the Polarizable Continuum Model
  functionality to any quantum chemistry program
* Create a playground for easily extending the implementation of the model

WWW: https://github.com/PCMSolver/pcmsolver
SVNWeb : Homepage : PortsMon
    Pseudo-pkg-plist information, but much better, from make generate-plist
    Expand this list (109 items)
  1. /usr/local/share/licenses/pcmsolver-1.1.11/catalog.mk
  2. /usr/local/share/licenses/pcmsolver-1.1.11/LICENSE
  3. /usr/local/share/licenses/pcmsolver-1.1.11/GPLv3
  4. bin/codata.py
  5. bin/docopt.py
  6. bin/getkw.py
  7. bin/pcmsolver.py
  8. bin/plot_cavity.py
  9. bin/pyparsing.py
  10. bin/run_pcm
  11. include/PCMSolver/Citation.hpp
  12. include/PCMSolver/Config.hpp
  13. include/PCMSolver/Cxx11Workarounds.hpp
  14. include/PCMSolver/ErrorHandling.hpp
  15. include/PCMSolver/FCMangle.hpp
  16. include/PCMSolver/GitInfo.hpp
  17. include/PCMSolver/LoggerInterface.hpp
  18. include/PCMSolver/PCMInput.h
  19. include/PCMSolver/PCMSolverExport.h
  20. include/PCMSolver/PhysicalConstants.hpp
  21. include/PCMSolver/STLUtils.hpp
  22. include/PCMSolver/TimerInterface.hpp
  23. include/PCMSolver/bi_operators/BIOperatorData.hpp
  24. include/PCMSolver/bi_operators/BoundaryIntegralOperator.hpp
  25. include/PCMSolver/bi_operators/Collocation.hpp
  26. include/PCMSolver/bi_operators/IBoundaryIntegralOperator.hpp
  27. include/PCMSolver/bi_operators/Numerical.hpp
  28. include/PCMSolver/bi_operators/Purisima.hpp
  29. include/PCMSolver/cavity/Cavity.hpp
  30. include/PCMSolver/cavity/CavityData.hpp
  31. include/PCMSolver/cavity/Element.hpp
  32. include/PCMSolver/cavity/GePolCavity.hpp
  33. include/PCMSolver/cavity/ICavity.hpp
  34. include/PCMSolver/cavity/RestartCavity.hpp
  35. include/PCMSolver/external/libtaylor/CMakeLists.txt
  36. include/PCMSolver/external/libtaylor/README
  37. include/PCMSolver/external/libtaylor/ctaylor.hpp
  38. include/PCMSolver/external/libtaylor/ctaylor_math.hpp
  39. include/PCMSolver/external/libtaylor/example.cpp
  40. include/PCMSolver/external/libtaylor/micromath.hpp
  41. include/PCMSolver/external/libtaylor/polymul.hpp
  42. include/PCMSolver/external/libtaylor/taylor.hpp
  43. include/PCMSolver/external/libtaylor/taylor_math.hpp
  44. include/PCMSolver/external/libtaylor/tmath.hpp
  45. include/PCMSolver/external/libtaylor/unittest_taylor.cpp
  46. include/PCMSolver/green/AnisotropicLiquid.hpp
  47. include/PCMSolver/green/DerivativeTypes.hpp
  48. include/PCMSolver/green/DerivativeUtils.hpp
  49. include/PCMSolver/green/Green.hpp
  50. include/PCMSolver/green/GreenData.hpp
  51. include/PCMSolver/green/GreenUtils.hpp
  52. include/PCMSolver/green/GreensFunction.hpp
  53. include/PCMSolver/green/IGreensFunction.hpp
  54. include/PCMSolver/green/InterfacesImpl.hpp
  55. include/PCMSolver/green/IonicLiquid.hpp
  56. include/PCMSolver/green/SphericalDiffuse.hpp
  57. include/PCMSolver/green/SphericalSharp.hpp
  58. include/PCMSolver/green/UniformDielectric.hpp
  59. include/PCMSolver/green/Vacuum.hpp
  60. include/PCMSolver/green/dielectric_profile/Anisotropic.hpp
  61. include/PCMSolver/green/dielectric_profile/MembraneTanh.hpp
  62. include/PCMSolver/green/dielectric_profile/Metal.hpp
  63. include/PCMSolver/green/dielectric_profile/OneLayerErf.hpp
  64. include/PCMSolver/green/dielectric_profile/OneLayerTanh.hpp
  65. include/PCMSolver/green/dielectric_profile/ProfileTypes.hpp
  66. include/PCMSolver/green/dielectric_profile/Sharp.hpp
  67. include/PCMSolver/green/dielectric_profile/Uniform.hpp
  68. include/PCMSolver/green/dielectric_profile/Yukawa.hpp
  69. include/PCMSolver/interface/Input.hpp
  70. include/PCMSolver/interface/Meddle.hpp
  71. include/PCMSolver/pcmsolver.h
  72. include/PCMSolver/solver/CPCMSolver.hpp
  73. include/PCMSolver/solver/IEFSolver.hpp
  74. include/PCMSolver/solver/ISolver.hpp
  75. include/PCMSolver/solver/Solver.hpp
  76. include/PCMSolver/solver/SolverData.hpp
  77. include/PCMSolver/solver/SolverImpl.hpp
  78. include/PCMSolver/utils/Atom.hpp
  79. include/PCMSolver/utils/ChargeDistribution.hpp
  80. include/PCMSolver/utils/Factory.hpp
  81. include/PCMSolver/utils/ForId.hpp
  82. include/PCMSolver/utils/FortranCUtils.hpp
  83. include/PCMSolver/utils/Logger.hpp
  84. include/PCMSolver/utils/LoggerImpl.hpp
  85. include/PCMSolver/utils/MathUtils.hpp
  86. include/PCMSolver/utils/Molecule.hpp
  87. include/PCMSolver/utils/QuadratureRules.hpp
  88. include/PCMSolver/utils/Solvent.hpp
  89. include/PCMSolver/utils/Sphere.hpp
  90. include/PCMSolver/utils/SplineFunction.hpp
  91. include/PCMSolver/utils/Stencils.hpp
  92. include/PCMSolver/utils/Symmetry.hpp
  93. include/PCMSolver/utils/Timer.hpp
  94. include/PCMSolver/utils/cnpy.hpp
  95. include/PCMSolver/utils/getkw/Getkw.h
  96. include/PCMSolver/utils/getkw/GetkwError.h
  97. include/PCMSolver/utils/getkw/Keyword.h
  98. include/PCMSolver/utils/getkw/Section.h
  99. lib/libpcm.a
  100. lib/libpcm.so
  101. lib/libpcm.so.1
  102. share/cmake/PCMSolver/PCMSolverConfig.cmake
  103. share/cmake/PCMSolver/PCMSolverConfigVersion.cmake
  104. share/cmake/PCMSolver/PCMSolverTargets-shared-release.cmake
  105. share/cmake/PCMSolver/PCMSolverTargets-shared.cmake
  106. share/cmake/PCMSolver/PCMSolverTargets-static-release.cmake
  107. share/cmake/PCMSolver/PCMSolverTargets-static.cmake
  108. @postexec /sbin/ldconfig -m /usr/local/lib
  109. @postunexec /sbin/ldconfig -R
  110. Collapse this list.

To install the port: cd /usr/ports/science/pcmsolver/ && make install clean
To add the package: pkg install pcmsolver

PKGNAME: pcmsolver

distinfo:

TIMESTAMP = 1510551005
SHA256 (PCMSolver-pcmsolver-v1.1.11_GH0.tar.gz) = c6af7d2a3ac8c09fc1835c952877b3444601c387a802b749668d162bb6ac6f36
SIZE (PCMSolver-pcmsolver-v1.1.11_GH0.tar.gz) = 98167952


NOTE: FreshPorts displays only information on required and default dependencies. Optional dependencies are not covered.

Build dependencies:
  1. cmake : devel/cmake
  2. gfortran6 : lang/gcc6
  3. python2.7 : lang/python27
  4. as : devel/binutils
Runtime dependencies:
  1. gfortran6 : lang/gcc6
  2. python2.7 : lang/python27
There are no ports dependent upon this port

Configuration Options
     No options to configure

USES:
cmake:outsource fortran python

Master Sites:
  1. https://codeload.github.com/PCMSolver/pcmsolver/tar.gz/v1.1.11?dummy=/

Number of commits found: 1

Commit History - (may be incomplete: see SVNWeb link above for full details)
DateByDescription
14 Nov 2017 18:05:42
Original commit files touched by this commit  1.1.11
Revision:454184
yuri search for other commits by this committer
New port: science/pcmsolver: API for the Polarizable Continuum Model

Approved by:	tcberner (mentor)
Differential Revision:	https://reviews.freebsd.org/D13069

Number of commits found: 1

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