psdi-data-conversion 0.0.33__py3-none-any.whl → 0.0.36__py3-none-any.whl

This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
Files changed (36) hide show
  1. psdi_data_conversion/app.py +23 -3
  2. psdi_data_conversion/constants.py +2 -0
  3. psdi_data_conversion/converter.py +16 -6
  4. psdi_data_conversion/converters/atomsk.py +3 -1
  5. psdi_data_conversion/converters/base.py +99 -39
  6. psdi_data_conversion/converters/c2x.py +3 -1
  7. psdi_data_conversion/converters/openbabel.py +40 -1
  8. psdi_data_conversion/database.py +5 -0
  9. psdi_data_conversion/main.py +18 -10
  10. psdi_data_conversion/static/content/accessibility.htm +5 -5
  11. psdi_data_conversion/static/content/convert.htm +31 -15
  12. psdi_data_conversion/static/content/convertato.htm +46 -28
  13. psdi_data_conversion/static/content/convertc2x.htm +47 -28
  14. psdi_data_conversion/static/content/documentation.htm +4 -4
  15. psdi_data_conversion/static/content/download.htm +4 -1
  16. psdi_data_conversion/static/content/feedback.htm +4 -4
  17. psdi_data_conversion/static/content/index-versions/psdi-common-header.html +1 -1
  18. psdi_data_conversion/static/content/psdi-common-header.html +1 -1
  19. psdi_data_conversion/static/content/report.htm +9 -7
  20. psdi_data_conversion/static/javascript/common.js +20 -0
  21. psdi_data_conversion/static/javascript/convert.js +1 -2
  22. psdi_data_conversion/static/javascript/convert_common.js +100 -7
  23. psdi_data_conversion/static/javascript/convertato.js +1 -2
  24. psdi_data_conversion/static/javascript/convertc2x.js +1 -2
  25. psdi_data_conversion/static/javascript/format.js +12 -0
  26. psdi_data_conversion/static/javascript/report.js +6 -0
  27. psdi_data_conversion/static/styles/format.css +13 -0
  28. psdi_data_conversion/static/styles/psdi-common.css +5 -2
  29. psdi_data_conversion/templates/index.htm +4 -1
  30. psdi_data_conversion/testing/conversion_test_specs.py +240 -149
  31. psdi_data_conversion/testing/utils.py +22 -7
  32. {psdi_data_conversion-0.0.33.dist-info → psdi_data_conversion-0.0.36.dist-info}/METADATA +29 -6
  33. {psdi_data_conversion-0.0.33.dist-info → psdi_data_conversion-0.0.36.dist-info}/RECORD +36 -36
  34. {psdi_data_conversion-0.0.33.dist-info → psdi_data_conversion-0.0.36.dist-info}/WHEEL +0 -0
  35. {psdi_data_conversion-0.0.33.dist-info → psdi_data_conversion-0.0.36.dist-info}/entry_points.txt +0 -0
  36. {psdi_data_conversion-0.0.33.dist-info → psdi_data_conversion-0.0.36.dist-info}/licenses/LICENSE +0 -0
@@ -1,12 +1,12 @@
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  psdi_data_conversion/__init__.py,sha256=urMsTqsTHTch1q4rMT9dgGnrvdPFMP9B8r-6Kr8H5sE,404
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- psdi_data_conversion/app.py,sha256=hIJEGiUVkBMjuXFOhk9HEkqV99tWkNSErC7OVmTlDpc,8149
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- psdi_data_conversion/constants.py,sha256=JpWqrjcCsLbZBWpiuP8XcR0y6wHT6EDMpiXBQwU-rfY,7274
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- psdi_data_conversion/converter.py,sha256=ejGBLYrDTSk2wBEOEYXa3rIHtV7-e1oE96a9JVNEpdE,22196
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- psdi_data_conversion/database.py,sha256=QVLWZqLVQvrn1rZvchugfu3kyDroN231_4BwjHOpAOs,44061
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+ psdi_data_conversion/app.py,sha256=LMVK3R8Ooz0vj8Pb4N5MkKQDOb91i5FhH5aHty5RDDM,8998
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+ psdi_data_conversion/constants.py,sha256=jh9-EqTt3E5I5H5axpANjQI_JuVeqsACoUVHuw6RX8Y,7351
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+ psdi_data_conversion/converter.py,sha256=f5Uos26M3KfDFQ-zoEOJVs0lEASkYRQyXrR0B9MhDmU,22906
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+ psdi_data_conversion/database.py,sha256=WMOdz6T2b2XuE_d-Ex_v5oRi-TDEHcku_yT04en4GoE,44274
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  psdi_data_conversion/dist.py,sha256=Ju6BcEuLrB738diTbK6HX6ZBiZ40Ctq1exj44nSCMlE,2292
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  psdi_data_conversion/file_io.py,sha256=UXxNxTl_EabQ96UrLp4b38ctkYhXV_KIHJeTuyRBVpM,8857
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  psdi_data_conversion/log_utility.py,sha256=WIgQp0pMsFtJJZKgIhStBNnjLzC6gEIodQAoXji5ht0,8789
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- psdi_data_conversion/main.py,sha256=I854YMpEgdwchQs0lXqR7U3leoz18U4_QqW7nylt_XE,37857
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+ psdi_data_conversion/main.py,sha256=90vCObJSG7Xxi_iyx2awskOt8RT9_Erel9rT8uz0n78,38203
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  psdi_data_conversion/security.py,sha256=wjdrMre29TpkF2NqrsXJ5sschSAnDzqLYTLUcNR21Qw,902
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  psdi_data_conversion/bin/LICENSE_ATOMSK,sha256=-Ay6SFTAf9x-OaRAiOgMNoutfUMLHx5jQQA1HqZ6p7I,34886
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  psdi_data_conversion/bin/LICENSE_C2X,sha256=-Ay6SFTAf9x-OaRAiOgMNoutfUMLHx5jQQA1HqZ6p7I,34886
@@ -15,26 +15,26 @@ psdi_data_conversion/bin/linux/c2x,sha256=gi4XsMbJu7lFxckc_FNYmfDf35yZPSToh6Hm5L
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  psdi_data_conversion/bin/mac/atomsk,sha256=pqExRdkR8NSqSasHZjE74R_CiM6Dkr_yvfyakdTWtI8,4502371
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  psdi_data_conversion/bin/mac/c2x,sha256=dI-bBoQ6uqc6KMYKJaq0x7ejJgOf_wysTxQA5BrF8AY,2581960
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  psdi_data_conversion/converters/__init__.py,sha256=15Ldt06eyZ0bgNPB4qg419U0Zcjt6TUCTzjCBo8EIzM,210
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- psdi_data_conversion/converters/atomsk.py,sha256=XaB73EGuxDpJXl4679Egdy9jbnP-O2aO8vMC_D4qd5o,1400
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- psdi_data_conversion/converters/base.py,sha256=yG4wqMpxnt-TBs-ACimI60gEdy1d3vhJsn1DjQ6U5BE,32672
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- psdi_data_conversion/converters/c2x.py,sha256=bGvh9FDim5KMHtZWblj6BV8NPg1_EVtmiv5zByqEhBE,1375
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- psdi_data_conversion/converters/openbabel.py,sha256=L_YN83C3PVpa2r67CKf7RVt_2UY6BpNvQg1jztKF0wM,10305
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+ psdi_data_conversion/converters/atomsk.py,sha256=_V33me1e4HW0-YXvdE-z6PdwtSK2gYV6QZf5d8aPqH4,1523
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+ psdi_data_conversion/converters/base.py,sha256=QTXOWEkrKmQvBANEmJilNtI3i0fRFkbVetVtYk8zXxw,35535
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+ psdi_data_conversion/converters/c2x.py,sha256=RjvOUxrb7R09s58p1kQKhICVUvozNJc4bvhQGkk89Ng,1498
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+ psdi_data_conversion/converters/openbabel.py,sha256=BGEXPdOfm5QNO67gymH8PrmW88pMvXF8_9fosz3_Bcg,13150
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  psdi_data_conversion/scripts/atomsk.sh,sha256=N_NMO5q8sI3Lt1TerC-xcKbMI0kfscAudy5UAbY0uR0,804
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  psdi_data_conversion/scripts/c2x.sh,sha256=F48jhgtgouKKZDQ9p6tCCNBN5bPuidBq2GcTurdWzQc,770
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- psdi_data_conversion/static/content/accessibility.htm,sha256=UMkkVouE_HgkI1gEpCtm-fHSlL40yjkqbkAvOrGUjxQ,14277
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- psdi_data_conversion/static/content/convert.htm,sha256=8dev0B8sFyi35R-SWDjhbBN-Y_70Hcfq1-YAguMCP20,6293
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- psdi_data_conversion/static/content/convertato.htm,sha256=uwYL9wpHbmIwJewy-5xSLU3H_q2lBSwqubaxkd0BfV0,2765
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- psdi_data_conversion/static/content/convertc2x.htm,sha256=LHMOnVDUzFHeSy-tyGLB0izCCs3fBGI1c9SA9YsmNlI,2764
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- psdi_data_conversion/static/content/documentation.htm,sha256=6lDc81OoUmcGp01a_3rxVSHunajBh-09QJZgedBcSFM,5647
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- psdi_data_conversion/static/content/download.htm,sha256=kPqCdjS6ssd77BHcCFKxm-QBhD-rpm13dUj4a7z-RY8,4094
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- psdi_data_conversion/static/content/feedback.htm,sha256=jFoOI3t1VVchBcQBZGjPaVo2qnHmrvrM7MJjuDylLQg,1878
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+ psdi_data_conversion/static/content/accessibility.htm,sha256=5mzlPM-d5KBoOuvuBTmer5QEI9lWQSd7FPH1KFn_7B0,14187
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+ psdi_data_conversion/static/content/convert.htm,sha256=sw4U8yQQXNYXl2ruYPfg6qIMozL2KMpWlKcAzn208X8,7166
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+ psdi_data_conversion/static/content/convertato.htm,sha256=IQ2PUodkWdZbbuvctDs2Ow0tEJXvhrnzhvGYDF7Oiiw,3669
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+ psdi_data_conversion/static/content/convertc2x.htm,sha256=mqMscskUPS1JtV1ABl91kH_JyCmK7ORFjD1n2_MZFz4,3669
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+ psdi_data_conversion/static/content/documentation.htm,sha256=1GiEjlDCP0kJ3CKkx3l1gPxeOPp4bdOP95MPKx4dzvI,5557
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+ psdi_data_conversion/static/content/download.htm,sha256=J_KwSKjWJJj9-v4ouGuddG_LIMmWzo7Zn7CjiJleUrw,4163
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+ psdi_data_conversion/static/content/feedback.htm,sha256=fZrhn4Egs9g6ygqPzV6ZG9ndYK02VdALNVNXRsZ716k,1788
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  psdi_data_conversion/static/content/header-links.html,sha256=7B2bHa7dLfSZ4hPMvVJ3kR0niVAOO3FtHJo0K6m1oP4,693
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  psdi_data_conversion/static/content/psdi-common-footer.html,sha256=CM9F6AXM1LVMLvTP51xTzOicEelSXlyXQyN-BjrQAJk,3933
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- psdi_data_conversion/static/content/psdi-common-header.html,sha256=I2YXZ92K2nsIAhLSKCA9zJHc5B_QGiB3HAbD0YDCw0g,1742
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- psdi_data_conversion/static/content/report.htm,sha256=o0Fn6QgKIEr2KtDoucQ203F3YhHQCIbAnbMvU7ylgh8,4530
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+ psdi_data_conversion/static/content/psdi-common-header.html,sha256=vRAgLGKE_RhXgBUQnarxnpkGl9j2Qeedqqo3VNDVGdk,1825
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+ psdi_data_conversion/static/content/report.htm,sha256=CRwlF7a7QvAjHsajuehWOtLxbo-JAjqrS_Q-I4BWxzs,4549
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  psdi_data_conversion/static/content/index-versions/header-links.html,sha256=WN9oZL7hLtH_yv5PvX3Ky7_YGrNvQL_RQ5eU8DB50Rg,764
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  psdi_data_conversion/static/content/index-versions/psdi-common-footer.html,sha256=zzizo_YEPhvH3_jNPFkFoKZA0TnIG6EXzQOsgooU1K8,3989
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- psdi_data_conversion/static/content/index-versions/psdi-common-header.html,sha256=FQevMlVaiQ8tRb381El7DYq_9VSNbtpL9EeImDdwDfM,1809
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+ psdi_data_conversion/static/content/index-versions/psdi-common-header.html,sha256=IXmvdlArY-60b7HgvKjcNF3eSmEmTImX7Hdasswyi5s,1907
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  psdi_data_conversion/static/data/data.json,sha256=_3o3BFEmnWGhoGMaviJsu-U9dJnk_tH9Wf0g-eDVWuU,3630027
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  psdi_data_conversion/static/img/colormode-toggle-dm.svg,sha256=Q85ODwU67chZ77lyT9gITtnmqzJEycFmz35dJuqaPXE,502
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@@ -61,26 +61,26 @@ psdi_data_conversion/static/img/ukri-epsr-logo-lighttext.png,sha256=Am-5nHjr-yA_
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- psdi_data_conversion/static/javascript/common.js,sha256=eAYSNrvRGx4ep2dIyMk1-J_biDvt-MWtUJNoSBUVXa4,1306
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- psdi_data_conversion/static/javascript/convert.js,sha256=BQt4nhTrMDclhrZSMssFsxDU5f1ZyRakmJ1bFvsLjes,9112
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- psdi_data_conversion/static/javascript/convert_common.js,sha256=uI-PrISECdHMEIOy7POE2xJFG9NMFjU1CocFo4ZZiy0,8842
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- psdi_data_conversion/static/javascript/convertato.js,sha256=km4BGyeNRoSL8uK6G7Zz0vOw2tO6KElasKR6sReFwGk,3593
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- psdi_data_conversion/static/javascript/convertc2x.js,sha256=0tRUU3eugmxlbVl2xXm0gHT1WDGbvlCmwDZw_-Ja-Sk,3588
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+ psdi_data_conversion/static/javascript/common.js,sha256=3YZdwfq54OPl-xIImTwjbXqxKqlrAaEbeac0cAHvScU,1720
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+ psdi_data_conversion/static/javascript/convert.js,sha256=UfrqaO7VNiLeed-d92O_jpKXRa63-0tCb_e-rqjTdFM,9074
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+ psdi_data_conversion/static/javascript/convert_common.js,sha256=o4KHIlYToC3AfOa8MTzbPaNDjPEesyvUy50AVgTRxvI,11000
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- psdi_data_conversion/static/javascript/format.js,sha256=xJM_1U-TETsYULvNr7nTt0MK38jvqnc6VxnFTjuBQrQ,20442
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- psdi_data_conversion/static/javascript/report.js,sha256=RP5EPVo44cTTfAvEdvSBR-zsg6dwqMb1brTukz4Pi4Y,12355
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- psdi_data_conversion/static/styles/format.css,sha256=gY20e3SP-Aszpla0NhjfxjkygHxHjYqNe-QcLqS-rkk,2858
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- psdi_data_conversion/static/styles/psdi-common.css,sha256=gx6h9gnw2ONvCd46QSzg-uLntxfhyoEYkf0P_U0Nhu8,17107
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- psdi_data_conversion/templates/index.htm,sha256=HE8YVUAFKey-JS-Z9EN6mdikYA98re5BP_62fLEg9yI,5612
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+ psdi_data_conversion/static/javascript/report.js,sha256=BHH5UOhXJtB6J_xk_y6woquNKt5W9hCrQapxKtGG1eA,12470
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+ psdi_data_conversion/static/styles/format.css,sha256=HKgKkepZtY0NCtKm4JlsuchDL_vymBQ0pRnmfVE8L30,3097
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  psdi_data_conversion/testing/__init__.py,sha256=Xku7drtLTYLLPsd403eC0LIEa_iohVifyeyAITy2w7U,135
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- psdi_data_conversion-0.0.33.dist-info/licenses/LICENSE,sha256=xx0jnfkXJvxRnG63LTGOxlggYnIysveWIZ6H3PNdCrQ,11357
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- psdi_data_conversion-0.0.33.dist-info/RECORD,,
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+ psdi_data_conversion-0.0.36.dist-info/licenses/LICENSE,sha256=xx0jnfkXJvxRnG63LTGOxlggYnIysveWIZ6H3PNdCrQ,11357
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+ psdi_data_conversion-0.0.36.dist-info/RECORD,,