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Port details
votca CSG and XTP: libraries for atomistic simulations
2026_3 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 View this port on Repology. pkg-fallout 2025.1_1Version of this port present on the latest quarterly branch.
Maintainer: yuri@FreeBSD.org search for ports maintained by this maintainer
Port Added: 2020-05-05 01:19:35
Last Update: 2026-05-05 19:29:37
Commit Hash: 2bf3834
License: APACHE20
WWW:
https://www.votca.org/
https://github.com/votca/votca
Description:
The Votca package contains two libraries: * VOTCA-CSG, a library which provides tools to develop coarse-grained potentials from atomistic simulation data * VOTCA-XTP, a library designed to determine electronic properties of organic materials from atomistic MD-trajectories.
HomepageHomepage    cgit ¦ Codeberg ¦ GitHub ¦ GitLab ¦ SVNWeb

Manual pages:
pkg-plist: as obtained via: make generate-plist
Expand this list (625 items)
Collapse this list.
  1. @ldconfig
  2. /usr/local/share/licenses/votca-2026_3/catalog.mk
  3. /usr/local/share/licenses/votca-2026_3/LICENSE
  4. /usr/local/share/licenses/votca-2026_3/APACHE20
  5. bin/VOTCARC.bash
  6. bin/csg_density
  7. bin/csg_dlptopol
  8. bin/csg_dump
  9. bin/csg_fluctuations
  10. bin/csg_fmatch
  11. bin/csg_gmxtopol
  12. bin/csg_imc_solve
  13. bin/csg_map
  14. bin/csg_orientcorr
  15. bin/csg_part_dist
  16. bin/csg_partial_rdf
  17. bin/csg_radii
  18. bin/csg_reupdate
  19. bin/csg_sphericalorder
  20. bin/csg_stat
  21. bin/csg_traj_force
  22. bin/xtp_autogen_mapping
  23. bin/xtp_basisset
  24. bin/xtp_map
  25. bin/xtp_modify_jobfile
  26. bin/xtp_parallel
  27. bin/xtp_qmmm2qm
  28. bin/xtp_run
  29. bin/xtp_tools
  30. bin/xtp_update_mapfile
  31. include/votca/csg/basebead.h
  32. include/votca/csg/bead.h
  33. include/votca/csg/beadlist.h
  34. include/votca/csg/beadmotif.h
  35. include/votca/csg/beadmotifalgorithms.h
  36. include/votca/csg/beadmotifconnector.h
  37. include/votca/csg/beadpair.h
  38. include/votca/csg/beadstructure.h
  39. include/votca/csg/beadstructurealgorithms.h
  40. include/votca/csg/beadtriple.h
  41. include/votca/csg/boundarycondition.h
  42. include/votca/csg/cgengine.h
  43. include/votca/csg/cgmoleculedef.h
  44. include/votca/csg/cgobserver.h
  45. include/votca/csg/csgapplication.h
  46. include/votca/csg/exclusionlist.h
  47. include/votca/csg/fileformatfactory.h
  48. include/votca/csg/imcio.h
  49. include/votca/csg/interaction.h
  50. include/votca/csg/map.h
  51. include/votca/csg/molecule.h
  52. include/votca/csg/moleculeitem.h
  53. include/votca/csg/nblist.h
  54. include/votca/csg/nblist_3body.h
  55. include/votca/csg/nblistgrid.h
  56. include/votca/csg/nblistgrid_3body.h
  57. include/votca/csg/nematicorder.h
  58. include/votca/csg/openbox.h
  59. include/votca/csg/orthorhombicbox.h
  60. include/votca/csg/pairlist.h
  61. include/votca/csg/pdbwriter.h
  62. include/votca/csg/potentialfunction.h
  63. include/votca/csg/potentialfunctioncbspl.h
  64. include/votca/csg/potentialfunctionlj126.h
  65. include/votca/csg/potentialfunctionljg.h
  66. include/votca/csg/residue.h
  67. include/votca/csg/topology.h
  68. include/votca/csg/topologymap.h
  69. include/votca/csg/topologyreader.h
  70. include/votca/csg/trajectoryreader.h
  71. include/votca/csg/trajectorywriter.h
  72. include/votca/csg/triclinicbox.h
  73. include/votca/csg/triplelist.h
  74. include/votca/csg/units.h
  75. include/votca/csg/version.h
  76. include/votca/csg/xyzreader.h
  77. include/votca/csg/xyzwriter.h
  78. include/votca/tools/NDimVector.h
  79. include/votca/tools/akimaspline.h
  80. include/votca/tools/application.h
  81. include/votca/tools/average.h
  82. include/votca/tools/calculator.h
  83. include/votca/tools/colors.h
  84. include/votca/tools/constants.h
  85. include/votca/tools/correlate.h
  86. include/votca/tools/crosscorrelate.h
  87. include/votca/tools/cubicspline.h
  88. include/votca/tools/datacollection.h
  89. include/votca/tools/edge.h
  90. include/votca/tools/edgecontainer.h
  91. include/votca/tools/eigen.h
  92. include/votca/tools/eigenio_matrixmarket.h
  93. include/votca/tools/eigensystem.h
  94. include/votca/tools/elements.h
  95. include/votca/tools/filesystem.h
  96. include/votca/tools/floatingpointcomparison.h
  97. include/votca/tools/getline.h
  98. include/votca/tools/globals.h
  99. include/votca/tools/graph.h
  100. include/votca/tools/graph_bf_visitor.h
  101. include/votca/tools/graph_df_visitor.h
  102. include/votca/tools/graphalgorithm.h
  103. include/votca/tools/graphdistvisitor.h
  104. include/votca/tools/graphnode.h
  105. include/votca/tools/graphvisitor.h
  106. include/votca/tools/histogram.h
  107. include/votca/tools/identity.h
  108. include/votca/tools/lexical_cast.h
  109. include/votca/tools/linalg.h
  110. include/votca/tools/linspline.h
  111. include/votca/tools/mutex.h
  112. include/votca/tools/name.h
  113. include/votca/tools/objectfactory.h
  114. include/votca/tools/optionshandler.h
  115. include/votca/tools/property.h
  116. include/votca/tools/propertyiomanipulator.h
  117. include/votca/tools/random.h
  118. include/votca/tools/rangeparser.h
  119. include/votca/tools/reducededge.h
  120. include/votca/tools/reducedgraph.h
  121. include/votca/tools/spline.h
  122. include/votca/tools/structureparameters.h
  123. include/votca/tools/table.h
  124. include/votca/tools/thread.h
  125. include/votca/tools/tokenizer.h
  126. include/votca/tools/types.h
  127. include/votca/tools/unitconverter.h
  128. include/votca/tools/version.h
  129. include/votca/tools/votca_tools_config.h
  130. include/votca/xtp/ERIs.h
  131. include/votca/xtp/GaussianQuadratureBase.h
  132. include/votca/xtp/ImaginaryAxisIntegration.h
  133. include/votca/xtp/IncrementalFockBuilder.h
  134. include/votca/xtp/IndexParser.h
  135. include/votca/xtp/activedensitymatrix.h
  136. include/votca/xtp/adiis.h
  137. include/votca/xtp/adiis_costfunction.h
  138. include/votca/xtp/amplitude_integration.h
  139. include/votca/xtp/anderson_mixing.h
  140. include/votca/xtp/aobasis.h
  141. include/votca/xtp/aomatrix.h
  142. include/votca/xtp/aopotential.h
  143. include/votca/xtp/aoshell.h
  144. include/votca/xtp/aotransform.h
  145. include/votca/xtp/atom.h
  146. include/votca/xtp/atomcontainer.h
  147. include/votca/xtp/basisset.h
  148. include/votca/xtp/bfgs_trm.h
  149. include/votca/xtp/bse.h
  150. include/votca/xtp/bse_operator.h
  151. include/votca/xtp/bse_population.h
  152. include/votca/xtp/bsecoupling.h
  153. include/votca/xtp/bseoperator_btda.h
  154. include/votca/xtp/calculatorfactory.h
  155. include/votca/xtp/chargecarrier.h
  156. include/votca/xtp/checkpoint.h
  157. include/votca/xtp/checkpoint_utils.h
  158. include/votca/xtp/checkpointreader.h
  159. include/votca/xtp/checkpointtable.h
  160. include/votca/xtp/checkpointwriter.h
  161. include/votca/xtp/classicalsegment.h
  162. include/votca/xtp/convergenceacc.h
  163. include/votca/xtp/couplingbase.h
  164. include/votca/xtp/cubefile_writer.h
  165. include/votca/xtp/cudamatrix.h
  166. include/votca/xtp/cudapipeline.h
  167. include/votca/xtp/davidsonsolver.h
  168. include/votca/xtp/density_integration.h
  169. include/votca/xtp/dftcoupling.h
  170. include/votca/xtp/dftengine.h
  171. include/votca/xtp/diis.h
  172. include/votca/xtp/dipoledipoleinteraction.h
  173. include/votca/xtp/ecpaobasis.h
  174. include/votca/xtp/ecpbasisset.h
  175. include/votca/xtp/eeinteractor.h
  176. include/votca/xtp/eigen.h
  177. include/votca/xtp/energy_terms.h
  178. include/votca/xtp/erdiabatization.h
  179. include/votca/xtp/esp2multipole.h
  180. include/votca/xtp/espfit.h
  181. include/votca/xtp/fcddiabatization.h
  182. include/votca/xtp/filterfactory.h
  183. include/votca/xtp/gaussianwriter.h
  184. include/votca/xtp/glink.h
  185. include/votca/xtp/gmhdiabatization.h
  186. include/votca/xtp/gnode.h
  187. include/votca/xtp/grid.h
  188. include/votca/xtp/grid_containers.h
  189. include/votca/xtp/gridbox.h
  190. include/votca/xtp/gw.h
  191. include/votca/xtp/gwbse.h
  192. include/votca/xtp/gwbseengine.h
  193. include/votca/xtp/gyration.h
  194. include/votca/xtp/hist.h
  195. include/votca/xtp/huffmantree.h
  196. include/votca/xtp/job.h
  197. include/votca/xtp/jobcalculator.h
  198. include/votca/xtp/jobcalculatorfactory.h
  199. include/votca/xtp/jobtopology.h
  200. include/votca/xtp/kmccalculator.h
  201. include/votca/xtp/logger.h
  202. include/votca/xtp/make_libint_work.h
  203. include/votca/xtp/matrixfreeoperator.h
  204. include/votca/xtp/md2qmengine.h
  205. include/votca/xtp/mmregion.h
  206. include/votca/xtp/molden.h
  207. include/votca/xtp/nbo.h
  208. include/votca/xtp/newton_rapson.h
  209. include/votca/xtp/openmp_cuda.h
  210. include/votca/xtp/optimiser_costfunction.h
  211. include/votca/xtp/orbitals.h
  212. include/votca/xtp/orbreorder.h
  213. include/votca/xtp/paircalculator.h
  214. include/votca/xtp/parallelxjobcalc.h
  215. include/votca/xtp/pmlocalization.h
  216. include/votca/xtp/polarregion.h
  217. include/votca/xtp/polarsite.h
  218. include/votca/xtp/populationanalysis.h
  219. include/votca/xtp/ppm.h
  220. include/votca/xtp/progressobserver.h
  221. include/votca/xtp/qmatom.h
  222. include/votca/xtp/qmcalculator.h
  223. include/votca/xtp/qmfragment.h
  224. include/votca/xtp/qmmolecule.h
  225. include/votca/xtp/qmnblist.h
  226. include/votca/xtp/qmpackage.h
  227. include/votca/xtp/qmpackagefactory.h
  228. include/votca/xtp/qmpair.h
  229. include/votca/xtp/qmregion.h
  230. include/votca/xtp/qmstate.h
  231. include/votca/xtp/qmthread.h
  232. include/votca/xtp/qmtool.h
  233. include/votca/xtp/quadrature_factory.h
  234. include/votca/xtp/radial_euler_maclaurin_rule.h
  235. include/votca/xtp/rate_engine.h
  236. include/votca/xtp/region.h
  237. include/votca/xtp/regular_grid.h
  238. include/votca/xtp/rpa.h
  239. include/votca/xtp/segid.h
  240. include/votca/xtp/segment.h
  241. include/votca/xtp/segmentmapper.h
  242. include/votca/xtp/sigma_base.h
  243. include/votca/xtp/sigmafactory.h
  244. include/votca/xtp/sphere_lebedev_rule.h
  245. include/votca/xtp/stateapplication.h
  246. include/votca/xtp/statefilter_base.h
  247. include/votca/xtp/statesaver.h
  248. include/votca/xtp/statetracker.h
  249. include/votca/xtp/staticregion.h
  250. include/votca/xtp/staticsite.h
  251. include/votca/xtp/symmetric_matrix.h
  252. include/votca/xtp/threecenter.h
  253. include/votca/xtp/toolfactory.h
  254. include/votca/xtp/topology.h
  255. include/votca/xtp/transition_densities.h
  256. include/votca/xtp/trustregion.h
  257. include/votca/xtp/vc2index.h
  258. include/votca/xtp/version.h
  259. include/votca/xtp/votca_xtp_config.h
  260. include/votca/xtp/vxc_functionals.h
  261. include/votca/xtp/vxc_grid.h
  262. include/votca/xtp/vxc_potential.h
  263. include/votca/xtp/xtpapplication.h
  264. lib/cmake/VOTCA_CSG/VOTCA_CSGConfig.cmake
  265. lib/cmake/VOTCA_CSG/VOTCA_CSGConfigVersion.cmake
  266. lib/cmake/VOTCA_CSG/VOTCA_CSG_Targets-release.cmake
  267. lib/cmake/VOTCA_CSG/VOTCA_CSG_Targets.cmake
  268. lib/cmake/VOTCA_TOOLS/FindFFTW3.cmake
  269. lib/cmake/VOTCA_TOOLS/VOTCA_TOOLSConfig.cmake
  270. lib/cmake/VOTCA_TOOLS/VOTCA_TOOLSConfigVersion.cmake
  271. lib/cmake/VOTCA_TOOLS/VOTCA_TOOLS_Targets-release.cmake
  272. lib/cmake/VOTCA_TOOLS/VOTCA_TOOLS_Targets.cmake
  273. lib/cmake/VOTCA_XTP/VOTCA_XTPConfig.cmake
  274. lib/cmake/VOTCA_XTP/VOTCA_XTPConfigVersion.cmake
  275. lib/cmake/VOTCA_XTP/VOTCA_XTP_Targets-release.cmake
  276. lib/cmake/VOTCA_XTP/VOTCA_XTP_Targets.cmake
  277. lib/libvotca_csg.so
  278. lib/libvotca_csg.so.2026
  279. lib/libvotca_tools.so
  280. lib/libvotca_tools.so.2026
  281. lib/libvotca_xtp.so
  282. lib/libvotca_xtp.so.2026
  283. share/man/man1/csg_density.1.gz
  284. share/man/man1/csg_dlptopol.1.gz
  285. share/man/man1/csg_dump.1.gz
  286. share/man/man1/csg_fluctuations.1.gz
  287. share/man/man1/csg_fmatch.1.gz
  288. share/man/man1/csg_gmxtopol.1.gz
  289. share/man/man1/csg_imc_solve.1.gz
  290. share/man/man1/csg_map.1.gz
  291. share/man/man1/csg_orientcorr.1.gz
  292. share/man/man1/csg_part_dist.1.gz
  293. share/man/man1/csg_partial_rdf.1.gz
  294. share/man/man1/csg_radii.1.gz
  295. share/man/man1/csg_reupdate.1.gz
  296. share/man/man1/csg_sphericalorder.1.gz
  297. share/man/man1/csg_stat.1.gz
  298. share/man/man1/csg_traj_force.1.gz
  299. share/man/man1/xtp_autogen_mapping.1.gz
  300. share/man/man1/xtp_basisset.1.gz
  301. share/man/man1/xtp_map.1.gz
  302. share/man/man1/xtp_modify_jobfile.1.gz
  303. share/man/man1/xtp_parallel.1.gz
  304. share/man/man1/xtp_qmmm2qm.1.gz
  305. share/man/man1/xtp_run.1.gz
  306. share/man/man1/xtp_tools.1.gz
  307. share/man/man1/xtp_update_mapfile.1.gz
  308. share/man/man7/votca-csg.7.gz
  309. share/man/man7/votca-tools.7.gz
  310. share/votca/rc/csg-completion.bash
  311. share/votca/template/CMakeLists.txt
  312. share/votca/template/template_serial.cc
  313. share/votca/template/template_threaded.cc
  314. share/votca/xml/csg_defaults.xml
  315. share/votca/xml/mapping.xml
  316. share/votca/xml/topol.xml
  317. share/votca/xtp-tutorials/GROMACS/KMC_Methane/GROMACS_KMC.ipynb
  318. share/votca/xtp-tutorials/GROMACS/KMC_Methane/change_energy.py
  319. share/votca/xtp-tutorials/GROMACS/KMC_Methane/lifetimes.xml
  320. share/votca/xtp-tutorials/GROMACS/Methane/MD_FILES/conf.gro
  321. share/votca/xtp-tutorials/GROMACS/Methane/MD_FILES/topol.tpr
  322. share/votca/xtp-tutorials/GROMACS/Methane/MP_FILES/Methane_e.mps
  323. share/votca/xtp-tutorials/GROMACS/Methane/MP_FILES/Methane_h.mps
  324. share/votca/xtp-tutorials/GROMACS/Methane/MP_FILES/Methane_n.mps
  325. share/votca/xtp-tutorials/GROMACS/Methane/MP_FILES/Methane_n2s1.mps
  326. share/votca/xtp-tutorials/GROMACS/Methane/MP_FILES/Methane_s1.mps
  327. share/votca/xtp-tutorials/GROMACS/Methane/QC_FILES/methane.xyz
  328. share/votca/xtp-tutorials/GROMACS/Methane/QMMM_GROMACS.ipynb
  329. share/votca/xtp-tutorials/GROMACS/Methane/eqm.xml
  330. share/votca/xtp-tutorials/GROMACS/Methane/iqm.xml
  331. share/votca/xtp-tutorials/GROMACS/Methane/qmmm.xml
  332. share/votca/xtp-tutorials/GROMACS/Methane/qmmm_mm.xml
  333. share/votca/xtp-tutorials/GROMACS/Methane/system.xml
  334. share/votca/xtp-tutorials/LAMMPS/KMC_Thiophene/LAMMPS_KMC.ipynb
  335. share/votca/xtp-tutorials/LAMMPS/KMC_Thiophene/state.hdf5
  336. share/votca/xtp-tutorials/LAMMPS/KMC_Thiophene/system.xml
  337. share/votca/xtp-tutorials/LAMMPS/Thiophene/MD_FILES/MD_Input/molecule_in_vacuum.data
  338. share/votca/xtp-tutorials/LAMMPS/Thiophene/MD_FILES/MD_Input/molecule_in_vacuum.in
  339. share/votca/xtp-tutorials/LAMMPS/Thiophene/MD_FILES/MD_Input/molecule_in_vacuum.in.init
  340. share/votca/xtp-tutorials/LAMMPS/Thiophene/MD_FILES/MD_Input/molecule_in_vacuum.in.output
  341. share/votca/xtp-tutorials/LAMMPS/Thiophene/MD_FILES/MD_Input/molecule_in_vacuum.in.run
  342. share/votca/xtp-tutorials/LAMMPS/Thiophene/MD_FILES/MD_Input/molecule_in_vacuum.in.settings
  343. share/votca/xtp-tutorials/LAMMPS/Thiophene/MD_FILES/newfile.data
  344. share/votca/xtp-tutorials/LAMMPS/Thiophene/MD_FILES/traj.dump
  345. share/votca/xtp-tutorials/LAMMPS/Thiophene/MP_FILES/GS_chelpg/log2mps.xml
  346. share/votca/xtp-tutorials/LAMMPS/Thiophene/MP_FILES/GS_chelpg/molpol.xml
  347. share/votca/xtp-tutorials/LAMMPS/Thiophene/MP_FILES/GS_chelpg/polar.xml
  348. share/votca/xtp-tutorials/LAMMPS/Thiophene/MP_FILES/GS_chelpg/system.gbw
  349. share/votca/xtp-tutorials/LAMMPS/Thiophene/MP_FILES/GS_chelpg/system.inp
  350. share/votca/xtp-tutorials/LAMMPS/Thiophene/MP_FILES/GS_chelpg/system.log
  351. share/votca/xtp-tutorials/LAMMPS/Thiophene/MP_FILES/GS_chelpg/system.pc_chelpg
  352. share/votca/xtp-tutorials/LAMMPS/Thiophene/MP_FILES/GS_chelpg/system.prop
  353. share/votca/xtp-tutorials/LAMMPS/Thiophene/MP_FILES/GS_chelpg/system.vpot
  354. share/votca/xtp-tutorials/LAMMPS/Thiophene/MP_FILES/GS_chelpg/system_property.txt
  355. share/votca/xtp-tutorials/LAMMPS/Thiophene/MP_FILES/GS_chelpg/thiophene_n-pol.mps
  356. share/votca/xtp-tutorials/LAMMPS/Thiophene/MP_FILES/GS_chelpg/thiophene_n.mps
  357. share/votca/xtp-tutorials/LAMMPS/Thiophene/MP_FILES/electron_chelpg/log2mps.xml
  358. share/votca/xtp-tutorials/LAMMPS/Thiophene/MP_FILES/electron_chelpg/molpol.xml
  359. share/votca/xtp-tutorials/LAMMPS/Thiophene/MP_FILES/electron_chelpg/polar.xml
  360. share/votca/xtp-tutorials/LAMMPS/Thiophene/MP_FILES/electron_chelpg/system.gbw
  361. share/votca/xtp-tutorials/LAMMPS/Thiophene/MP_FILES/electron_chelpg/system.inp
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  584. share/votca/xtp/ecps/corelevels.xml
  585. share/votca/xtp/ecps/def2-ecp.xml
  586. share/votca/xtp/ecps/ecp.xml
  587. share/votca/xtp/xml/apdft.xml
  588. share/votca/xtp/xml/coupling.xml
  589. share/votca/xtp/xml/densityanalysis.xml
  590. share/votca/xtp/xml/dftgwbse.xml
  591. share/votca/xtp/xml/diabatization.xml
  592. share/votca/xtp/xml/eanalyze.xml
  593. share/votca/xtp/xml/einternal.xml
  594. share/votca/xtp/xml/eqm.xml
  595. share/votca/xtp/xml/excitoncoupling.xml
  596. share/votca/xtp/xml/gencube.xml
  597. share/votca/xtp/xml/gpu_benchmark.xml
  598. share/votca/xtp/xml/ianalyze.xml
  599. share/votca/xtp/xml/iexcitoncl.xml
  600. share/votca/xtp/xml/iqm.xml
  601. share/votca/xtp/xml/kmclifetime.xml
  602. share/votca/xtp/xml/kmcmultiple.xml
  603. share/votca/xtp/xml/log2mps.xml
  604. share/votca/xtp/xml/mapchecker.xml
  605. share/votca/xtp/xml/mol2orb.xml
  606. share/votca/xtp/xml/molpol.xml
  607. share/votca/xtp/xml/neighborlist.xml
  608. share/votca/xtp/xml/orb2fchk.xml
  609. share/votca/xtp/xml/orb2mol.xml
  610. share/votca/xtp/xml/partialcharges.xml
  611. share/votca/xtp/xml/qmmm.xml
  612. share/votca/xtp/xml/spectrum.xml
  613. share/votca/xtp/xml/subpackages/bsecoupling.xml
  614. share/votca/xtp/xml/subpackages/dftcoupling.xml
  615. share/votca/xtp/xml/subpackages/dftpackage.xml
  616. share/votca/xtp/xml/subpackages/esp2multipole.xml
  617. share/votca/xtp/xml/subpackages/gwbse.xml
  618. share/votca/xtp/xml/subpackages/localize.xml
  619. share/votca/xtp/xml/subpackages/polar.xml
  620. share/votca/xtp/xml/subpackages/region.xml
  621. share/votca/xtp/xml/subpackages/statetracker.xml
  622. share/votca/xtp/xml/vaverage.xml
  623. @owner
  624. @group
  625. @mode
Collapse this list.
USE_RC_SUBR (Service Scripts)
  • no SUBR information found for this port
Dependency lines:
  • votca>0:science/votca
To install the port:
cd /usr/ports/science/votca/ && make install clean
To add the package, run one of these commands:
  • pkg install science/votca
  • pkg install votca
NOTE: If this package has multiple flavors (see below), then use one of them instead of the name specified above.
PKGNAME: votca
Flavors: there is no flavor information for this port.
distinfo:
TIMESTAMP = 1775976527 SHA256 (votca-votca-v2026_GH0.tar.gz) = bf5827e93aecdfd040131ef8427f49efac4ea87d30882c2eb83fea16a054fbc8 SIZE (votca-votca-v2026_GH0.tar.gz) = 40248995

Packages (timestamps in pop-ups are UTC):
votca
ABIaarch64amd64armv6armv7i386powerpcpowerpc64powerpc64le
FreeBSD:13:latest-----n/an/an/a
FreeBSD:13:quarterly2025.1_12025.1_1---n/an/an/a
FreeBSD:14:latest-2026_3------
FreeBSD:14:quarterly2025.1_12025.1_1------
FreeBSD:15:latest-2026_3n/a-n/an/a--
FreeBSD:15:quarterly2025.1_12025.1_1n/a-n/an/a--
FreeBSD:16:latest--n/a-n/an/a--
Dependencies
NOTE: FreshPorts displays only information on required and default dependencies. Optional dependencies are not covered.
Build dependencies:
  1. bash : shells/bash
  2. lmp : science/lammps
  3. py311-ase>0 : science/py-ase@py311
  4. py311-h5py>0 : science/py-h5py@py311
  5. py311-lxml>0 : devel/py-lxml@py311
  6. py311-xmltodict>0 : devel/py-xmltodict@py311
  7. rdkit>0 : science/rdkit
  8. cmake : devel/cmake-core
  9. ninja : devel/ninja
  10. eigen3.pc : math/eigen3
  11. pkgconf>=1.3.0_1 : devel/pkgconf
  12. perl5>=5.42.r<5.43 : lang/perl5.42
Test dependencies:
  1. py311-pytest>0 : devel/py-pytest@py311
Runtime dependencies:
  1. bash : shells/bash
  2. py311-numpy>=1.16 : math/py-numpy@py311
  3. py311-ase>0 : science/py-ase@py311
  4. py311-h5py>0 : science/py-h5py@py311
  5. py311-lxml>0 : devel/py-lxml@py311
  6. py311-xmltodict>0 : devel/py-xmltodict@py311
  7. rdkit>0 : science/rdkit
  8. python3.11 : lang/python311
  9. perl5>=5.42.r<5.43 : lang/perl5.42
Library dependencies:
  1. libboost_program_options.so : devel/boost-libs
  2. libecpint.so : science/libecpint
  3. libexpat.so : textproc/expat2
  4. libfftw3.so : math/fftw3
  5. libgromacs_d.so : science/gromacs
  6. libhdf5.so : science/hdf5
  7. libint2.so : science/libint2
  8. libsz.so : science/libaec
  9. libxc.so : science/libxc
There are no ports dependent upon this port

Configuration Options:
===> The following configuration options are available for votca-2026_3: APPS=on: Build applications ===> Use 'make config' to modify these settings
Options name:
science_votca
USES:
cmake compiler:c++14-lang eigen:3 perl5 pkgconfig python:run shebangfix
FreshPorts was unable to extract/find any pkg message
Master Sites:
Expand this list (1 items)
Collapse this list.
  1. https://codeload.github.com/votca/votca/tar.gz/v2026?dummy=/
Collapse this list.

Number of commits found: 59

Commit History - (may be incomplete: for full details, see links to repositories near top of page)
CommitCreditsLog message
2026_3
05 May 2026 19:29:37
commit hash: 2bf3834a197ccf8956332378eda8dd7577965246commit hash: 2bf3834a197ccf8956332378eda8dd7577965246commit hash: 2bf3834a197ccf8956332378eda8dd7577965246commit hash: 2bf3834a197ccf8956332378eda8dd7577965246 files touched by this commit
Max Brazhnikov (makc) search for other commits by this committer
*/*: bump PORTREVISION after switching to NumPy 2.x
2026_2
05 May 2026 19:29:37
commit hash: b0b4d9e1eae890d0de1591e20fb37358439a2ff6commit hash: b0b4d9e1eae890d0de1591e20fb37358439a2ff6commit hash: b0b4d9e1eae890d0de1591e20fb37358439a2ff6commit hash: b0b4d9e1eae890d0de1591e20fb37358439a2ff6 files touched by this commit Sanity Test Failure
Max Brazhnikov (makc) search for other commits by this committer
*/*: Switch to NumPy 2.x

PR:		294328
Exp-run:	antoine
2026_2
21 Apr 2026 06:39:04
commit hash: b8b84d83e93192cabd9e9f7d28d20373eb95e68fcommit hash: b8b84d83e93192cabd9e9f7d28d20373eb95e68fcommit hash: b8b84d83e93192cabd9e9f7d28d20373eb95e68fcommit hash: b8b84d83e93192cabd9e9f7d28d20373eb95e68f files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/libxc: update 6.2.2 → 7.0.0
2026_1
19 Apr 2026 07:10:33
commit hash: 6978db2dccd902340ac8733dd88b958d1dd09215commit hash: 6978db2dccd902340ac8733dd88b958d1dd09215commit hash: 6978db2dccd902340ac8733dd88b958d1dd09215commit hash: 6978db2dccd902340ac8733dd88b958d1dd09215 files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/gromacs: update 2025.4 → 2026.1
2026
12 Apr 2026 07:29:42
commit hash: e09116fe2193f0d882333936b38a76e79a542034commit hash: e09116fe2193f0d882333936b38a76e79a542034commit hash: e09116fe2193f0d882333936b38a76e79a542034commit hash: e09116fe2193f0d882333936b38a76e79a542034 files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/votca: update 2025.1 → 2026
2025.1_2
03 Apr 2026 20:52:43
commit hash: d04d23ae37d04c8ddf74c04ee868900b9189295acommit hash: d04d23ae37d04c8ddf74c04ee868900b9189295acommit hash: d04d23ae37d04c8ddf74c04ee868900b9189295acommit hash: d04d23ae37d04c8ddf74c04ee868900b9189295a files touched by this commit
Charlie Li (vishwin) search for other commits by this committer
python.mk: retire ${PYNUMPY}

With both math/py-numpy (2) and math/py-numpy1, the variable stopped
making sense. Also remove the upper version bound.
2025.1_2
03 Apr 2026 18:52:22
commit hash: d4bd5ba72edc9f537254aeb1ff893399e3eb2278commit hash: d4bd5ba72edc9f537254aeb1ff893399e3eb2278commit hash: d4bd5ba72edc9f537254aeb1ff893399e3eb2278commit hash: d4bd5ba72edc9f537254aeb1ff893399e3eb2278 files touched by this commit
Charlie Li (vishwin) search for other commits by this committer
math/py-numpy: switch all consumers to math/py-numpy1

...and bump PORTREVISIONs of consumers with hard RUN_DEPENDS

PR: 281470
2025.1_1
29 Mar 2026 23:25:50
commit hash: e1893dcaca06ce6f520e349233ccb4b261c9fe98commit hash: e1893dcaca06ce6f520e349233ccb4b261c9fe98commit hash: e1893dcaca06ce6f520e349233ccb4b261c9fe98commit hash: e1893dcaca06ce6f520e349233ccb4b261c9fe98 files touched by this commit
Dima Panov (fluffy) search for other commits by this committer
science/votca: add missing #include <cassert>

Reported by:	bulk -t
Approved by:	portmgr blanket
2025.1_1
20 Oct 2025 11:48:39
commit hash: 67fb95fb3bd5e61957877f5ac31cd790bff786b5commit hash: 67fb95fb3bd5e61957877f5ac31cd790bff786b5commit hash: 67fb95fb3bd5e61957877f5ac31cd790bff786b5commit hash: 67fb95fb3bd5e61957877f5ac31cd790bff786b5 files touched by this commit
Dima Panov (fluffy) search for other commits by this committer
devel/boost: bump consumers after boost upgrade (+)

Get rid of direct dependency ob libbost_system.so, use libboost_thread.so
instead
2025.1
12 Oct 2025 09:51:25
commit hash: 67b06428e7beaee048fed6b945ae8bf92a1b3d5ecommit hash: 67b06428e7beaee048fed6b945ae8bf92a1b3d5ecommit hash: 67b06428e7beaee048fed6b945ae8bf92a1b3d5ecommit hash: 67b06428e7beaee048fed6b945ae8bf92a1b3d5e files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/votca: update 2025 → 2025.1
2025_4
15 Sep 2025 13:55:40
commit hash: a6233e5a2fdfc3f67a89a90ac005521f25395355commit hash: a6233e5a2fdfc3f67a89a90ac005521f25395355commit hash: a6233e5a2fdfc3f67a89a90ac005521f25395355commit hash: a6233e5a2fdfc3f67a89a90ac005521f25395355 files touched by this commit
Hiroki Tagato (tagattie) search for other commits by this committer
*/*: switch dependency from devel/py-lxml5 to devel/py-lxml

Currently, there are two versions of python XML processing library
which conflict each other in the ports tree, namely:
- devel/py-lxml5 (now at version 5.4.0)
- devel/py-lxml  (now at version 6.0.1)

To avoid the situation that some ports depend on py-lxml5 and some
others do on py-lxml (by switching dependencies individually), this
commit switches the dependencies from py-lxml5 to py-lxml at once.

Additional note: There are still two ports (textproc/py-rdflib and
www/py-draftjs-exporter) depending on py-lxml5 since they limit upper
version to less than 6.

PR:		289491
Approved by:	Michiel van Baak Jansen <michiel@vanbaak.eu>, arrowd,
		crees, madpilot, delphij, marcus, nivit, kai,
		skreuzer, fluffy, bofh, thierry, stephen, sunpoet,
		0mp, Eric Camachat <eric@camachat.org>
2025_3
31 Aug 2025 10:30:51
commit hash: b304d8ab18ac96ddcd15f3cf7255ef89aababe5acommit hash: b304d8ab18ac96ddcd15f3cf7255ef89aababe5acommit hash: b304d8ab18ac96ddcd15f3cf7255ef89aababe5acommit hash: b304d8ab18ac96ddcd15f3cf7255ef89aababe5a files touched by this commit
Rene Ladan (rene) search for other commits by this committer
all: bump PORTREVISION after updating graphics/libyuv

Using the Tools/scripts/bump_revision.pl script
2025_2
23 Jul 2025 04:05:15
commit hash: e68a16062a88568c20b4b5c54bf051a14b33d1d4commit hash: e68a16062a88568c20b4b5c54bf051a14b33d1d4commit hash: e68a16062a88568c20b4b5c54bf051a14b33d1d4commit hash: e68a16062a88568c20b4b5c54bf051a14b33d1d4 files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/votca: Not broken on 13
2025_2
22 Jul 2025 22:03:46
commit hash: d63353fffc1ffcfb7d638f672987f6fe73daf412commit hash: d63353fffc1ffcfb7d638f672987f6fe73daf412commit hash: d63353fffc1ffcfb7d638f672987f6fe73daf412commit hash: d63353fffc1ffcfb7d638f672987f6fe73daf412 files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/votca: Broken on 13

Reported by:	fallout
2025_2
22 Jul 2025 07:10:54
commit hash: 610f4d0bea9e85615a5ad6713ead9030ec663f59commit hash: 610f4d0bea9e85615a5ad6713ead9030ec663f59commit hash: 610f4d0bea9e85615a5ad6713ead9030ec663f59commit hash: 610f4d0bea9e85615a5ad6713ead9030ec663f59 files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/votca: Update WWW
2025_2
21 Jul 2025 08:00:55
commit hash: 0b0f7cda9d34dc0169a7b91fa134903f2d822526commit hash: 0b0f7cda9d34dc0169a7b91fa134903f2d822526commit hash: 0b0f7cda9d34dc0169a7b91fa134903f2d822526commit hash: 0b0f7cda9d34dc0169a7b91fa134903f2d822526 files touched by this commit
Hiroki Tagato (tagattie) search for other commits by this committer
*/*: update dependency on devel/py-lxml to devel/py-lxml5 (2nd attempt)

This is a follow up to the commit 230fb2661c78, which updated some
ports' dependencies on devel/py-lxml to devel/py-lxml5. It was an
attempt to follow the dependency change of
www/py-beautifulsoup. However, the switch was incomplete and broke
some other ports.

It has turned out that the ports depending on devel/py-lxml (at
version 4.9.3) does not limit their dependencies' upper bound to 4.x
except for one (devel/py-pymaven-patch). So updating them to
devel/py-lxml5 (at version 5.4.0) should cause no harm.

This commit switch dependencies of all the ports (except
devel/py-pymaven-patch) to devel/py-lxml5 avoid potential conflicts.

Co-authored-by: Daniel Engberg <diizzy@FreeBSD.org>

PR:		287144, 288047
Reported by:	makc (via ports-committers),
		vvd (PR 288047),
		diizzy (PR 287144)
Approved by:	portmgr (chase dependency change, unbreak build)
Fixes:		230fb2661c78 (*/*: update dependency on devel/py-lxml to devel/py-lxml5)
2025_1
02 Jun 2025 00:40:43
commit hash: 18632db919ce49d62374e1020f0320153951f834commit hash: 18632db919ce49d62374e1020f0320153951f834commit hash: 18632db919ce49d62374e1020f0320153951f834commit hash: 18632db919ce49d62374e1020f0320153951f834 files touched by this commit
Dima Panov (fluffy) search for other commits by this committer
devel/boost: bump consumers after Boost update
2025
29 Mar 2025 16:27:47
commit hash: a0ccb138784cd6cc94a6aac6a53716c900bfd1f6commit hash: a0ccb138784cd6cc94a6aac6a53716c900bfd1f6commit hash: a0ccb138784cd6cc94a6aac6a53716c900bfd1f6commit hash: a0ccb138784cd6cc94a6aac6a53716c900bfd1f6 files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/votca: update 2024.2 → 2025

Reported by:	portscout
2024.2_3
14 Feb 2025 03:17:22
commit hash: fa53920e7219d4246816f65034ad058e81de3353commit hash: fa53920e7219d4246816f65034ad058e81de3353commit hash: fa53920e7219d4246816f65034ad058e81de3353commit hash: fa53920e7219d4246816f65034ad058e81de3353 files touched by this commit
Dima Panov (fluffy) search for other commits by this committer
devel/boost: bump consumers after Boost-1.87 update

Sponsored by:	Future Crew, LLC
2024.2_2
20 Nov 2024 10:05:25
commit hash: 312ee18b022b4abcb14973bb10894ba152b8f60bcommit hash: 312ee18b022b4abcb14973bb10894ba152b8f60bcommit hash: 312ee18b022b4abcb14973bb10894ba152b8f60bcommit hash: 312ee18b022b4abcb14973bb10894ba152b8f60b files touched by this commit
Dima Panov (fluffy) search for other commits by this committer
devel/boost: bump consu,ers after update Boost to 1.86 release

Sponsored by:	Future Crew, LLC
2024.2_1
03 Oct 2024 10:25:14
commit hash: 55cfbcf56c31f949cd93e4012c1d705c1094a5c6commit hash: 55cfbcf56c31f949cd93e4012c1d705c1094a5c6commit hash: 55cfbcf56c31f949cd93e4012c1d705c1094a5c6commit hash: 55cfbcf56c31f949cd93e4012c1d705c1094a5c6 files touched by this commit
Dima Panov (fluffy) search for other commits by this committer
*/*: bump consumers after devel/boost* update

With hat:	office
Sponsored by:	Future Crew, LLC
2024.2
30 Sep 2024 08:28:25
commit hash: a87ec48d8dddafa91a0b07d177ee2e042675e7c8commit hash: a87ec48d8dddafa91a0b07d177ee2e042675e7c8commit hash: a87ec48d8dddafa91a0b07d177ee2e042675e7c8commit hash: a87ec48d8dddafa91a0b07d177ee2e042675e7c8 files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/votca: update 2024.1 → 2024.2

Reported by:	portscout
2024.1
17 Jul 2024 15:17:16
commit hash: d6eec8b590445dd2b1af57d91b6dc932a63ae995commit hash: d6eec8b590445dd2b1af57d91b6dc932a63ae995commit hash: d6eec8b590445dd2b1af57d91b6dc932a63ae995commit hash: d6eec8b590445dd2b1af57d91b6dc932a63ae995 files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/votca: update 2024 → 2024.1

Reported by:	portscout
2024
29 Mar 2024 16:06:09
commit hash: 8c0f9ab01ebee7299cf68c83116cc172b5d6b02ccommit hash: 8c0f9ab01ebee7299cf68c83116cc172b5d6b02ccommit hash: 8c0f9ab01ebee7299cf68c83116cc172b5d6b02ccommit hash: 8c0f9ab01ebee7299cf68c83116cc172b5d6b02c files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/votca: update 2023 → 2024
2023_1
13 Feb 2024 14:44:22
commit hash: db616534ff99d6268997e2f30858891e20641a1ecommit hash: db616534ff99d6268997e2f30858891e20641a1ecommit hash: db616534ff99d6268997e2f30858891e20641a1ecommit hash: db616534ff99d6268997e2f30858891e20641a1e files touched by this commit
Dima Panov (fluffy) search for other commits by this committer
devel/boost: bump consumers after library update
2023
14 Dec 2023 02:13:24
commit hash: bd628760e02616c45e2e7b87723a2346656710fdcommit hash: bd628760e02616c45e2e7b87723a2346656710fdcommit hash: bd628760e02616c45e2e7b87723a2346656710fdcommit hash: bd628760e02616c45e2e7b87723a2346656710fd files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/votca: Fix build by fixing plist

Reported by:	fallout
2023
19 Nov 2023 09:36:25
commit hash: 423db3f5b02b6e269946e7ee90be6bfcf542b329commit hash: 423db3f5b02b6e269946e7ee90be6bfcf542b329commit hash: 423db3f5b02b6e269946e7ee90be6bfcf542b329commit hash: 423db3f5b02b6e269946e7ee90be6bfcf542b329 files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/votca: update 2022.1 → 2023

Reported by:	portscout
2022.1_1
14 Oct 2023 17:38:19
commit hash: 744d2334a25046ed65a47331b711194fcce877f3commit hash: 744d2334a25046ed65a47331b711194fcce877f3commit hash: 744d2334a25046ed65a47331b711194fcce877f3commit hash: 744d2334a25046ed65a47331b711194fcce877f3 files touched by this commit
Daniel Engberg (diizzy) search for other commits by this committer
science/votca: Partially fix build

Define BOOST_TIMER_ENABLE_DEPRECATED in CXXFLAGS to avoid build failure
with newer versions of Boost library

Poudriere reports filesystem violations in usr/local/share/libint

PR:		274437
Reviewed by:	yuri (maintainer)
2022.1_1
27 Sep 2023 14:36:30
commit hash: 21d8008e86830262f2a33a6dca9ddf2478cd6487commit hash: 21d8008e86830262f2a33a6dca9ddf2478cd6487commit hash: 21d8008e86830262f2a33a6dca9ddf2478cd6487commit hash: 21d8008e86830262f2a33a6dca9ddf2478cd6487 files touched by this commit
Dima Panov (fluffy) search for other commits by this committer
devel/boost*: bump all consumers after 1.83.0
2022.1
07 Jun 2023 04:45:25
commit hash: b6dc8438b6b355fc38381ada231044bca37300a7commit hash: b6dc8438b6b355fc38381ada231044bca37300a7commit hash: b6dc8438b6b355fc38381ada231044bca37300a7commit hash: b6dc8438b6b355fc38381ada231044bca37300a7 files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/votca: Update 2022 → 2022.1

Reported by:	portscout
2022_8
27 Apr 2023 18:25:55
commit hash: 3e45e8e24481fab02384c55a1e655d1dc1b781c6commit hash: 3e45e8e24481fab02384c55a1e655d1dc1b781c6commit hash: 3e45e8e24481fab02384c55a1e655d1dc1b781c6commit hash: 3e45e8e24481fab02384c55a1e655d1dc1b781c6 files touched by this commit
Dima Panov (fluffy) search for other commits by this committer
*/*: bump all direct Boost cunsumers
2022_7
23 Apr 2023 09:09:58
commit hash: 8d3e020ed032a8db00208994d0db646de7dc6f5bcommit hash: 8d3e020ed032a8db00208994d0db646de7dc6f5bcommit hash: 8d3e020ed032a8db00208994d0db646de7dc6f5bcommit hash: 8d3e020ed032a8db00208994d0db646de7dc6f5b files touched by this commit
Gerald Pfeifer (gerald) search for other commits by this committer
*: Bump PORTREVISIONs for math/mpc update to 1.3.1
2022_6
16 Jan 2023 19:32:07
commit hash: e1287d0d1228d93e469256fa6c4c824b9d20426bcommit hash: e1287d0d1228d93e469256fa6c4c824b9d20426bcommit hash: e1287d0d1228d93e469256fa6c4c824b9d20426bcommit hash: e1287d0d1228d93e469256fa6c4c824b9d20426b files touched by this commit
Dima Panov (fluffy) search for other commits by this committer
*/*:	bump libboost*.so libraries consumert after Boost upgrade
2022_5
05 Nov 2022 14:47:18
commit hash: cceff449fd65e82dae764ff16b72000d1cd0454bcommit hash: cceff449fd65e82dae764ff16b72000d1cd0454bcommit hash: cceff449fd65e82dae764ff16b72000d1cd0454bcommit hash: cceff449fd65e82dae764ff16b72000d1cd0454b files touched by this commit
Thierry Thomas (thierry) search for other commits by this committer
science/*: bump PORTREVISION in consumers of libXC
07 Sep 2022 21:58:51
commit hash: fb16dfecae4a6efac9f3a78e0b759fb7a3c53de4commit hash: fb16dfecae4a6efac9f3a78e0b759fb7a3c53de4commit hash: fb16dfecae4a6efac9f3a78e0b759fb7a3c53de4commit hash: fb16dfecae4a6efac9f3a78e0b759fb7a3c53de4 files touched by this commit
Stefan Eßer (se) search for other commits by this committer
Remove WWW entries moved into port Makefiles

Commit b7f05445c00f has added WWW entries to port Makefiles based on
WWW: lines in pkg-descr files.

This commit removes the WWW: lines of moved-over URLs from these
pkg-descr files.

Approved by:		portmgr (tcberner)
2022_4
07 Sep 2022 21:10:59
commit hash: b7f05445c00f2625aa19b4154ebcbce5ed2daa52commit hash: b7f05445c00f2625aa19b4154ebcbce5ed2daa52commit hash: b7f05445c00f2625aa19b4154ebcbce5ed2daa52commit hash: b7f05445c00f2625aa19b4154ebcbce5ed2daa52 files touched by this commit
Stefan Eßer (se) search for other commits by this committer
Add WWW entries to port Makefiles

It has been common practice to have one or more URLs at the end of the
ports' pkg-descr files, one per line and prefixed with "WWW:". These
URLs should point at a project website or other relevant resources.

Access to these URLs required processing of the pkg-descr files, and
they have often become stale over time. If more than one such URL was
present in a pkg-descr file, only the first one was tarnsfered into
the port INDEX, but for many ports only the last line did contain the
port specific URL to further information.

There have been several proposals to make a project URL available as
a macro in the ports' Makefiles, over time.
(Only the first 15 lines of the commit message are shown above View all of this commit message)
2022_4
12 Aug 2022 14:46:53
commit hash: 4cf39decb348615b9c8a28370d987a85d1b8a5edcommit hash: 4cf39decb348615b9c8a28370d987a85d1b8a5edcommit hash: 4cf39decb348615b9c8a28370d987a85d1b8a5edcommit hash: 4cf39decb348615b9c8a28370d987a85d1b8a5ed files touched by this commit
Dima Panov (fluffy) search for other commits by this committer
*/*: bump all consumers after recent boost upgrade
2022_3
20 Jul 2022 14:35:24
commit hash: 5564b3b420db29745d2d4981d1963200ddf53e35commit hash: 5564b3b420db29745d2d4981d1963200ddf53e35commit hash: 5564b3b420db29745d2d4981d1963200ddf53e35commit hash: 5564b3b420db29745d2d4981d1963200ddf53e35 files touched by this commit
Tobias C. Berner (tcberner) search for other commits by this committer
science/hdf5: bump PORTREVISION of consumers

The SO-version increased in the update to 1.12.2 in
a43418b81530f7e897abfbe18dd59f44265a1a0f .

Reported by:	VVD <vvd@unislabs.com>
2022_2
18 Jul 2022 12:51:29
commit hash: d98decf4c6f7a8d92e742a8fd7b7795818a0904fcommit hash: d98decf4c6f7a8d92e742a8fd7b7795818a0904fcommit hash: d98decf4c6f7a8d92e742a8fd7b7795818a0904fcommit hash: d98decf4c6f7a8d92e742a8fd7b7795818a0904f files touched by this commit
Po-Chuan Hsieh (sunpoet) search for other commits by this committer
science/votca: Fix build with HDF5 1.12.0+
2022_2
16 Jun 2022 15:13:01
commit hash: 328ae4074233a5b85e0e38efece1af5dcc218160commit hash: 328ae4074233a5b85e0e38efece1af5dcc218160commit hash: 328ae4074233a5b85e0e38efece1af5dcc218160commit hash: 328ae4074233a5b85e0e38efece1af5dcc218160 files touched by this commit
Po-Chuan Hsieh (sunpoet) search for other commits by this committer
*/*: Replace science/szip with science/libaec

- Bump PORTREVISION of dependent ports for dependency change

szip does not allow redistribution in binary form without proper commercial
license. Its LICENSE_PERMS should be set to no-auto-accept which blocks building
this port, therefore building dependent ports are also blocked. Switch all
dependent ports to science/libaec to avoid conflicts and license issue.

PR:		228743, 246097, 250165
2022_1
22 May 2022 20:17:16
commit hash: b082b3d13e8c4872b73fb681eb99b261926ac9cdcommit hash: b082b3d13e8c4872b73fb681eb99b261926ac9cdcommit hash: b082b3d13e8c4872b73fb681eb99b261926ac9cdcommit hash: b082b3d13e8c4872b73fb681eb99b261926ac9cd files touched by this commit
Dima Panov (fluffy) search for other commits by this committer
devel/boost-all: bump all library consumers after boost upgrade

PR:	246106
2022
16 May 2022 06:49:43
commit hash: 2d34c2bfeaa82867acfa7d73bec9644b2acecbb1commit hash: 2d34c2bfeaa82867acfa7d73bec9644b2acecbb1commit hash: 2d34c2bfeaa82867acfa7d73bec9644b2acecbb1commit hash: 2d34c2bfeaa82867acfa7d73bec9644b2acecbb1 files touched by this commit
Loïc Bartoletti (lbartoletti) search for other commits by this committer
devel/cmake: Update to 3.23.0

Update to 3.23.0.
Fix pkg-plist: using the default share/man location

Release Notes:
  https://cmake.org/cmake/help/v3.23/release/3.23.html

PR:		262886
Exp-run by:	antoine
2022
25 Jan 2022 07:52:16
commit hash: b07d5299192a7d1979e0fdfbe3926f81fb686eb8commit hash: b07d5299192a7d1979e0fdfbe3926f81fb686eb8commit hash: b07d5299192a7d1979e0fdfbe3926f81fb686eb8commit hash: b07d5299192a7d1979e0fdfbe3926f81fb686eb8 files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/votca: Fix tests
2022
24 Jan 2022 21:28:00
commit hash: 322c0325932a5a2f6ed89821f82f27a3edddef8fcommit hash: 322c0325932a5a2f6ed89821f82f27a3edddef8fcommit hash: 322c0325932a5a2f6ed89821f82f27a3edddef8fcommit hash: 322c0325932a5a2f6ed89821f82f27a3edddef8f files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/votca: Update 2021.2-18560 -> 2022

Reported by:	portscout
2021.2.18560
29 Sep 2021 00:49:03
commit hash: 8eac9dc021cfbd1073894448cb07edb922954585commit hash: 8eac9dc021cfbd1073894448cb07edb922954585commit hash: 8eac9dc021cfbd1073894448cb07edb922954585commit hash: 8eac9dc021cfbd1073894448cb07edb922954585 files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/votca: Update 2021.2 -> 2021.2-18560

This fixed 6 failing testcases. The patch fixing these testcases
doesn't apply to 2021.2, so the port is updated to the latest
commit.
2021.2
24 Sep 2021 02:04:20
commit hash: fae27f575deb8a4f41c2fb0679a1eb74a1704f7ecommit hash: fae27f575deb8a4f41c2fb0679a1eb74a1704f7ecommit hash: fae27f575deb8a4f41c2fb0679a1eb74a1704f7ecommit hash: fae27f575deb8a4f41c2fb0679a1eb74a1704f7e files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/votca: Update 2021.1 -> 2021.2

Reported by:	portscout
2021.1
19 Jul 2021 00:49:20
commit hash: 08fcb6c859c194e67a6421e230ce0e80bb6700efcommit hash: 08fcb6c859c194e67a6421e230ce0e80bb6700efcommit hash: 08fcb6c859c194e67a6421e230ce0e80bb6700efcommit hash: 08fcb6c859c194e67a6421e230ce0e80bb6700ef files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/votca: Update 2021 -> 2021.1

Reported by:	portscout
2021
07 Apr 2021 08:09:01
commit hash: cf118ccf875508b9a1c570044c93cfcc82bd455ccommit hash: cf118ccf875508b9a1c570044c93cfcc82bd455ccommit hash: cf118ccf875508b9a1c570044c93cfcc82bd455ccommit hash: cf118ccf875508b9a1c570044c93cfcc82bd455c files touched by this commit
Mathieu Arnold (mat) search for other commits by this committer
One more small cleanup, forgotten yesterday.
Reported by:	lwhsu
2021
06 Apr 2021 14:31:07
commit hash: 305f148f482daf30dcf728039d03d019f88344ebcommit hash: 305f148f482daf30dcf728039d03d019f88344ebcommit hash: 305f148f482daf30dcf728039d03d019f88344ebcommit hash: 305f148f482daf30dcf728039d03d019f88344eb files touched by this commit
Mathieu Arnold (mat) search for other commits by this committer
Remove # $FreeBSD$ from Makefiles.
2021
14 Mar 2021 07:38:07
Revision:568364Original commit files touched by this commit
yuri search for other commits by this committer
science/votca: Update 1.6.3 -> 2021

Reported by:	portscout
1.6.3
18 Dec 2020 05:40:58
Revision:558351Original commit files touched by this commit
yuri search for other commits by this committer
science/votca: Update 1.6.2 -> 1.6.3
1.6.2_1
12 Dec 2020 17:04:37
Revision:557839Original commit files touched by this commit
thierry search for other commits by this committer
- Upgrade math/eigen3 to 3.3.8;

- Add some dependencies which might be detected by Find_Package but not
registered;

- Bump PORTREVISION of consumers.

PR:		250833
Submitted by:	/me
Approved by:	tcberner@ (KDE / maintainer) + exp-run
1.6.2
29 Aug 2020 18:44:12
Revision:546934Original commit files touched by this commit
yuri search for other commits by this committer
science/votca: Update 1.6.1 -> 1.6.2

Reported by:	portscout
1.6.1
24 Jun 2020 02:07:29
Revision:540011Original commit files touched by this commit
yuri search for other commits by this committer
science/votca: Update 1.6 -> 1.6.1

Reported by:	portscout
1.6_1
17 Jun 2020 01:57:30
Revision:539398Original commit files touched by this commit
yuri search for other commits by this committer
science/votca: Revert unintended changes
1.6_1
17 Jun 2020 01:54:26
Revision:539397Original commit files touched by this commit
yuri search for other commits by this committer
science/votca: Broken on i386

Reported by:	fallout
1.6_1
06 May 2020 12:04:05
Revision:534168Original commit files touched by this commit
linimon search for other commits by this committer
Add compiler:c++14-lang to USES to fix build on GCC-based systems:

  Target "cmTC_057ba" requires the language dialect "CXX14" , but CMake does
  not know the compile flags to use to enable it.

Approved by:	portmgr (tier-2 blanket)
1.6_1
05 May 2020 05:13:52
Revision:534024Original commit files touched by this commit
yuri search for other commits by this committer
science/votca: Enable the XTP library
1.6
05 May 2020 01:19:23
Revision:534004Original commit files touched by this commit
yuri search for other commits by this committer
New port: science/votca: CSG and XTP: libraries for atomistic simulations

Number of commits found: 59