biotite 0.40.0__cp311-cp311-macosx_11_0_arm64.whl → 0.41.0__cp311-cp311-macosx_11_0_arm64.whl

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Files changed (90) hide show
  1. biotite/__init__.py +1 -1
  2. biotite/database/pubchem/download.py +23 -23
  3. biotite/database/pubchem/query.py +7 -7
  4. biotite/file.py +17 -9
  5. biotite/sequence/align/banded.c +119 -119
  6. biotite/sequence/align/banded.cpython-311-darwin.so +0 -0
  7. biotite/sequence/align/cigar.py +60 -15
  8. biotite/sequence/align/kmeralphabet.c +119 -119
  9. biotite/sequence/align/kmeralphabet.cpython-311-darwin.so +0 -0
  10. biotite/sequence/align/kmersimilarity.c +119 -119
  11. biotite/sequence/align/kmersimilarity.cpython-311-darwin.so +0 -0
  12. biotite/sequence/align/kmertable.cpp +119 -119
  13. biotite/sequence/align/kmertable.cpython-311-darwin.so +0 -0
  14. biotite/sequence/align/localgapped.c +119 -119
  15. biotite/sequence/align/localgapped.cpython-311-darwin.so +0 -0
  16. biotite/sequence/align/localungapped.c +119 -119
  17. biotite/sequence/align/localungapped.cpython-311-darwin.so +0 -0
  18. biotite/sequence/align/multiple.c +119 -119
  19. biotite/sequence/align/multiple.cpython-311-darwin.so +0 -0
  20. biotite/sequence/align/pairwise.c +119 -119
  21. biotite/sequence/align/pairwise.cpython-311-darwin.so +0 -0
  22. biotite/sequence/align/permutation.c +119 -119
  23. biotite/sequence/align/permutation.cpython-311-darwin.so +0 -0
  24. biotite/sequence/align/selector.c +119 -119
  25. biotite/sequence/align/selector.cpython-311-darwin.so +0 -0
  26. biotite/sequence/align/tracetable.c +119 -119
  27. biotite/sequence/align/tracetable.cpython-311-darwin.so +0 -0
  28. biotite/sequence/annotation.py +2 -2
  29. biotite/sequence/codec.c +119 -119
  30. biotite/sequence/codec.cpython-311-darwin.so +0 -0
  31. biotite/sequence/io/fasta/convert.py +27 -24
  32. biotite/sequence/phylo/nj.c +119 -119
  33. biotite/sequence/phylo/nj.cpython-311-darwin.so +0 -0
  34. biotite/sequence/phylo/tree.c +119 -119
  35. biotite/sequence/phylo/tree.cpython-311-darwin.so +0 -0
  36. biotite/sequence/phylo/upgma.c +119 -119
  37. biotite/sequence/phylo/upgma.cpython-311-darwin.so +0 -0
  38. biotite/structure/__init__.py +2 -0
  39. biotite/structure/bonds.c +1124 -915
  40. biotite/structure/bonds.cpython-311-darwin.so +0 -0
  41. biotite/structure/celllist.c +119 -119
  42. biotite/structure/celllist.cpython-311-darwin.so +0 -0
  43. biotite/structure/charges.c +119 -119
  44. biotite/structure/charges.cpython-311-darwin.so +0 -0
  45. biotite/structure/dotbracket.py +2 -0
  46. biotite/structure/info/atoms.py +6 -1
  47. biotite/structure/info/bonds.py +1 -1
  48. biotite/structure/info/ccd/amino_acids.txt +17 -0
  49. biotite/structure/info/ccd/carbohydrates.txt +2 -0
  50. biotite/structure/info/ccd/components.bcif +0 -0
  51. biotite/structure/info/ccd/nucleotides.txt +1 -0
  52. biotite/structure/info/misc.py +69 -5
  53. biotite/structure/integrity.py +19 -70
  54. biotite/structure/io/ctab.py +12 -106
  55. biotite/structure/io/general.py +157 -165
  56. biotite/structure/io/gro/file.py +16 -16
  57. biotite/structure/io/mmtf/convertarray.c +119 -119
  58. biotite/structure/io/mmtf/convertarray.cpython-311-darwin.so +0 -0
  59. biotite/structure/io/mmtf/convertfile.c +119 -119
  60. biotite/structure/io/mmtf/convertfile.cpython-311-darwin.so +0 -0
  61. biotite/structure/io/mmtf/decode.c +119 -119
  62. biotite/structure/io/mmtf/decode.cpython-311-darwin.so +0 -0
  63. biotite/structure/io/mmtf/encode.c +119 -119
  64. biotite/structure/io/mmtf/encode.cpython-311-darwin.so +0 -0
  65. biotite/structure/io/mol/__init__.py +4 -2
  66. biotite/structure/io/mol/convert.py +71 -7
  67. biotite/structure/io/mol/ctab.py +414 -0
  68. biotite/structure/io/mol/header.py +116 -0
  69. biotite/structure/io/mol/{file.py → mol.py} +69 -82
  70. biotite/structure/io/mol/sdf.py +909 -0
  71. biotite/structure/io/pdb/file.py +84 -31
  72. biotite/structure/io/pdb/hybrid36.cpython-311-darwin.so +0 -0
  73. biotite/structure/io/pdbx/__init__.py +0 -1
  74. biotite/structure/io/pdbx/bcif.py +2 -3
  75. biotite/structure/io/pdbx/cif.py +9 -5
  76. biotite/structure/io/pdbx/component.py +4 -1
  77. biotite/structure/io/pdbx/convert.py +203 -79
  78. biotite/structure/io/pdbx/encoding.c +119 -119
  79. biotite/structure/io/pdbx/encoding.cpython-311-darwin.so +0 -0
  80. biotite/structure/repair.py +253 -0
  81. biotite/structure/sasa.c +119 -119
  82. biotite/structure/sasa.cpython-311-darwin.so +0 -0
  83. biotite/structure/sequence.py +112 -0
  84. biotite/structure/superimpose.py +472 -13
  85. {biotite-0.40.0.dist-info → biotite-0.41.0.dist-info}/METADATA +2 -2
  86. {biotite-0.40.0.dist-info → biotite-0.41.0.dist-info}/RECORD +89 -85
  87. biotite/structure/io/pdbx/error.py +0 -14
  88. {biotite-0.40.0.dist-info → biotite-0.41.0.dist-info}/LICENSE.rst +0 -0
  89. {biotite-0.40.0.dist-info → biotite-0.41.0.dist-info}/WHEEL +0 -0
  90. {biotite-0.40.0.dist-info → biotite-0.41.0.dist-info}/top_level.txt +0 -0
@@ -1,12 +1,12 @@
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- biotite-0.40.0.dist-info/RECORD,,
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- biotite-0.40.0.dist-info/WHEEL,sha256=sieEctgmsyAnWfDYOiunmkigyyjGmYuUaApm_YItwoI,110
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- biotite-0.40.0.dist-info/LICENSE.rst,sha256=ZuNQuB65Dxf0rDB_5LxvA4SVQJBWxRZyvbjbvE-APWY,1534
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- biotite-0.40.0.dist-info/top_level.txt,sha256=Tvj5T6Zfz3AhevTRlDRVhNC1WgPlFk-wDtSkzTgFM8w,8
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- biotite-0.40.0.dist-info/METADATA,sha256=F_Wg3VF0txg1mUbDMmCGUR4_Omt6fNY_xpNmUqEeMoQ,7151
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+ biotite-0.41.0.dist-info/RECORD,,
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+ biotite-0.41.0.dist-info/WHEEL,sha256=sieEctgmsyAnWfDYOiunmkigyyjGmYuUaApm_YItwoI,110
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+ biotite-0.41.0.dist-info/LICENSE.rst,sha256=ZuNQuB65Dxf0rDB_5LxvA4SVQJBWxRZyvbjbvE-APWY,1534
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+ biotite-0.41.0.dist-info/top_level.txt,sha256=Tvj5T6Zfz3AhevTRlDRVhNC1WgPlFk-wDtSkzTgFM8w,8
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+ biotite-0.41.0.dist-info/METADATA,sha256=aDKbtvmKoRovoSXYPhKN_VjcLFM8XkfPSmqKV0X9zQ4,7152
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  biotite/copyable.py,sha256=Rmsso_e9quxWc23SBQh2M45jTT36SerwSmt3ONng04M,1972
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- biotite/__init__.py,sha256=xHwZNZlRcAlkSZFw6EMrVf5GqBoft7VfnmLDkqxF2Fo,522
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+ biotite/__init__.py,sha256=O2aZEDRPWHZaO2ApwDuoh6i-zEjYXqKJBtp6zMqPg6s,522
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  biotite/visualize.py,sha256=mLME6fOGwdcUZLUzDTbwUpZokC4D1cVE6ICdtJDc0yw,9842
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- biotite/file.py,sha256=flQknYLaLSlbX38D8_I3fG9DAo4D3ExeoRzweMoZMno,7335
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+ biotite/file.py,sha256=te0tI2Qdh9JQlwe_FgkyWIU6RG6WYgWNbAj3GF3wzh0,7429
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  biotite/temp.py,sha256=AenIC7m3rrezikJDKgTEnLZigACubfsw_UcmYMGyGa8,2045
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  biotite/database/error.py,sha256=oEJGj28R9VRkLt_DcsqNsf-rwHe3E2ma5uduzqAgZ1w,408
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  biotite/database/__init__.py,sha256=_C25CsDE8O_770Vmk6sCK4FKlQ0A1hUhWaMRPOvkDtM,724
@@ -21,8 +21,8 @@ biotite/database/uniprot/query.py,sha256=bzJenXwN3iKLxwJT9uaB19LBam8GRYWfeBzS_Py
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  biotite/database/uniprot/download.py,sha256=rWrgLrDCnItLe5fU3_oSZvYJToqWmqfffN5JvBumdyM,4378
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  biotite/database/uniprot/__init__.py,sha256=Lsk5Jd-qb5167VTgN48lWSSbqpjCM-fD0XKJyxaZb7o,334
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  biotite/database/pubchem/error.py,sha256=5kLtd9r3KkR9PZfTEfaRA5LRIG2K-XQKqiEBZZ0pd4g,711
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- biotite/database/pubchem/query.py,sha256=odzR1G-psQnMAcWL97pj_xc9BH6sUlgru1vg4SD00Vc,26440
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- biotite/database/pubchem/download.py,sha256=rio_-ykW1xAZhhWcd-U88NYrwcI1lsJNrG75PEuGRfc,10117
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+ biotite/database/pubchem/query.py,sha256=PBXIMhxWxIsTZQDDsnConZbm3j7GZwYqgN_ldn9bZsk,26425
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+ biotite/database/pubchem/download.py,sha256=gRNWiHlMMWWCDBjgsAmtvygkM3Agc8yQeuwV2VKeJtQ,9997
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  biotite/database/pubchem/__init__.py,sha256=Lnk0h85FzSFBu6KAG3P5ssbGfXE2lX-EMYXWCafPF0o,668
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  biotite/database/pubchem/throttle.py,sha256=RzMFaBKJVWygH2QlLQEFO_EBcN7nGxj6Sq-sAB7njvY,3534
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  biotite/database/rcsb/query.py,sha256=I5eAsdsW8FT-O0cKz_71dpS-HrEe0VtauliAPQMPBSo,33065
@@ -57,9 +57,9 @@ biotite/application/clustalo/app.py,sha256=tPZFZ5SP1jCE1OQlTz7WzFOmdZ5B6JHTTjaCU
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  biotite/application/muscle/app3.py,sha256=tm51pw2zuDcuua-an5eaD_oBGh_PBL8vdlGdfUkXLF4,8450
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  biotite/application/muscle/__init__.py,sha256=UZFXceMzefsY6Y1CokOpWC2ZgWeiM8NiCHqEzLJDeQ8,337
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  biotite/application/muscle/app5.py,sha256=9tbw6XISmu9CEvFPDxoXW72HnrpAPf0MZY4jH7F8jK0,4799
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- biotite/sequence/codec.c,sha256=XiuE3BqpAsjsYM7GRdk9ZKwE72ic82cSnpdAaW8D0sQ,1534101
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- biotite/sequence/codec.cpython-311-darwin.so,sha256=RHQ0tMVIhBCEz5BJR7XkyZYQ4Q-iBsT9J7tc3ivgp18,318824
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- biotite/sequence/annotation.py,sha256=h8e1IJhmHXoqs8yw1Y6QwFLrGcb5XF8ewDkkxPhThXo,29786
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+ biotite/sequence/codec.c,sha256=YQzeIu4GoRUZ_kvHl9QAarj-VzP-Z3lAUop7FB9xaLA,1534101
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+ biotite/sequence/codec.cpython-311-darwin.so,sha256=yhF8NYfHKxvJatQwJlvHk05LdwHLq4B1inyhdO9YLrM,318824
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+ biotite/sequence/annotation.py,sha256=ab49UyMA1StDMGL-67NG75FRYes4-1qM7RAqxYbPxeE,29746
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  biotite/sequence/sequence.py,sha256=AbOf4a3ApXUBgflzYRux2nqpd6jDCXVAByUBkt9Jroo,11911
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  biotite/sequence/codon_tables.txt,sha256=zZLT642H4qEkwUk5g-hWh-6ZWP_bgaz70fWcxwJDWJ0,10209
@@ -70,7 +70,7 @@ biotite/sequence/search.py,sha256=er8lqF2WM4rFG3gixxgEnJ8yNHiWae--02TjJCNRo1c,31
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  biotite/sequence/alphabet.py,sha256=l4iggmKPNvfauKeRRGbJWmmrzkFldljxMBpFoRG8Uks,17785
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  biotite/sequence/io/__init__.py,sha256=4K13uxFWe8IpNC8yuVxjDiI7-8lmXu7qT6iMmVSqPs4,314
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- biotite/sequence/io/fasta/convert.py,sha256=xNAq43nTSIpSVTOFbW1AwOvgQPZulvTmPD1eNWpyON8,9450
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+ biotite/sequence/io/fasta/convert.py,sha256=saQmgRHqnhqqTmbSf3rn4_m6RcVulGEFeVK7g928rdI,9433
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  biotite/sequence/io/gff/convert.py,sha256=BnAMkQl7mVO6b2vupznhDyd5-tpbhYKstCRMmhlEmOM,4699
@@ -84,35 +84,35 @@ biotite/sequence/io/genbank/file.py,sha256=lY5LPFJU7q1mGWkE_iF8XQgBzkY_3aOFCxI9n
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- biotite/sequence/align/selector.cpython-311-darwin.so,sha256=n2DHENGRAe0upQti23Il_GhmU_jVD7WFZpINWEsHmMU,343755
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- biotite/sequence/align/banded.c,sha256=mnS98aBgT1EkzdoYmEPPJ4xjWbOM_0bpdQ1kyqqjme4,2583643
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- biotite/sequence/align/localungapped.c,sha256=ye8kU8WuTlimPpMe_La4NbdQe28JclQJ4WBUKug6Uw0,1610949
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+ biotite/sequence/align/selector.cpython-311-darwin.so,sha256=tJtIVqDXU-ldjckd8vvizET3UNAodA8loH6By8P9Rao,343755
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+ biotite/sequence/align/banded.c,sha256=Lsz_VwAUp9_bXRwXwKt3HAx0LiZZbv_G-jXD8r2nXlY,2583643
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+ biotite/sequence/align/localungapped.c,sha256=eDnyg6zjOmj430UwvViT3hXlsND29BWNM0pOqNutOzo,1610949
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- biotite/sequence/align/kmeralphabet.cpython-311-darwin.so,sha256=n5yTMuoTdV8xHnmushdm0m6LQHukjXc77MtpmDQ0_jk,397023
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+ biotite/sequence/align/kmeralphabet.cpython-311-darwin.so,sha256=eJHvL78RiVuIrbDrTXpfyaEqRVKqCrZvopdlBi8hiAs,397023
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- biotite/sequence/align/localgapped.c,sha256=zCjsnqpn-o5WzjJ8AkyGDfuMmJ7QjxU7_GKd3emcZmY,4604705
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- biotite/sequence/align/kmertable.cpython-311-darwin.so,sha256=FkHkvYO6vnoDm9RMP9nfEhefd1Knxx6KSoTgYnapTvc,751948
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+ biotite/sequence/align/localgapped.c,sha256=0RfmAnzGcndtfCihqBsVWQeHdOLBzPtH0oxcu-9_plE,4604705
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+ biotite/sequence/align/kmertable.cpython-311-darwin.so,sha256=Q_ceSW_PZamFPT1YJ7BY3Co-wSyd6QyJTO1uDhR1pLc,751948
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- biotite/sequence/align/kmertable.cpp,sha256=U3Vt6N5NihnNmhvybclC9quOP5-smSdyb5NUfhCDV5Q,3035277
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- biotite/sequence/align/kmersimilarity.cpython-311-darwin.so,sha256=ZQVIWTWs1_sbG8BmOY9aL6QLdnoX5dWqMObcHLLTXVU,247729
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+ biotite/sequence/align/kmersimilarity.c,sha256=rg-AmN2wiEB9jb-TMwuCGhMbbjk0KwevEtVXyWQ2Iss,1257695
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+ biotite/sequence/align/kmertable.cpp,sha256=oOSC7fXAnrf8_w02zMjTwBMyrXItta8xLCiTuhIbPoQ,3035277
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+ biotite/sequence/align/kmersimilarity.cpython-311-darwin.so,sha256=iyqPZ8aXYW9KjGagzJmYJqEhu7XvY5DDfPlFZJYaaTE,247729
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- biotite/sequence/align/tracetable.cpython-311-darwin.so,sha256=O6Uhlq5ttCY_xDSjI7Ih0TVVpLBIhWBWOEhybPPLTAE,204973
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+ biotite/sequence/align/tracetable.cpython-311-darwin.so,sha256=t6SC-EXmO6g24eKQlsUqRNFyumHel4QupE7OENquRc0,204973
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- biotite/sequence/align/cigar.py,sha256=Mk3kECMKkKWxLLgIZ1hkADsz_2AJJHrAPMulfKTCA9I,12915
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- biotite/sequence/align/selector.c,sha256=7m3u3rvFPqET5t19u_MvuHZPHRpLV74geAvud95m8MY,1637723
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+ biotite/sequence/align/multiple.cpython-311-darwin.so,sha256=gURKwVvUbI4YgmCjkpD3OTHLK-ntSILX0aTeLh87ejM,546843
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+ biotite/sequence/align/permutation.cpython-311-darwin.so,sha256=5InhDhWxxuBPlDLOsxb8HtRfwCzmf4EqqjZk_SAAxVs,250382
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+ biotite/sequence/align/cigar.py,sha256=chS5LnAwHPZmCw-zKVR4apAuSMuxaxxuoDG2w9fLWFg,14647
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+ biotite/sequence/align/selector.c,sha256=nyE5sZmN63nlMYZqjfdgra0dijddv1wmbRTkIemy5rQ,1637723
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- biotite/sequence/align/permutation.c,sha256=K_Ufu_Jgn_pBOuaCMK5rKhiFzLRSFgKi6hQpR7NnkSQ,1283868
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- biotite/sequence/align/kmeralphabet.c,sha256=T9QapsGUqEYNIivlqSkSE3t6303Vp5vdcIdhEcE_kQs,1917858
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- biotite/sequence/align/pairwise.cpython-311-darwin.so,sha256=gISS33_eIsChYF1oqI1LSF_Na47uAz1W4PZrP3rNKt4,631179
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- biotite/sequence/align/multiple.c,sha256=hUZK7AlTr3xSTx0ZYtaN8NwUkezTwT5awwX7XZRsrCs,2280166
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- biotite/sequence/align/pairwise.c,sha256=EMQka4MWB1EY0vxWMqAm5x4zzmNP74tbE9fdUxWA3HY,2887759
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- biotite/sequence/align/banded.cpython-311-darwin.so,sha256=bi3QtMX8n0sGQ1JcJU1dhNrFbI6HjS2YKhBTHDA7Yhw,578201
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- biotite/sequence/align/localgapped.cpython-311-darwin.so,sha256=9ZYTnan-MfabDjDQInCQ3EH7WITebw57wqjGn-VGvKI,1163998
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+ biotite/sequence/align/permutation.c,sha256=U99sK5TnVEtoifsGM4SVB_tvQpWkouytSZ9PvqwXPIM,1283868
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+ biotite/sequence/align/kmeralphabet.c,sha256=lK_3Li4k4nbrqwnl7BnyUtVjWnYwv57-zRFuoeX8t3M,1917858
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+ biotite/sequence/align/banded.cpython-311-darwin.so,sha256=s8df8zf6aQZb_CKpVFoBJ0qDG-z8caJ3WHDmnxItB0s,578201
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+ biotite/sequence/align/localgapped.cpython-311-darwin.so,sha256=QFCp_kkwtPrSqJ1PkjqI9sSe-IIJSa4sBOeTzBYP_G0,1163998
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+ biotite/sequence/align/tracetable.c,sha256=92tzAb33OvvxrmMnHYIS0fCV-166E5FPVfvU-oDCI1g,1224026
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+ biotite/sequence/phylo/nj.c,sha256=Ugh20wePXCAwUFI4uPbNd4mAFlKDhENuGCfgvZtvvJQ,1226152
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- biotite/sequence/phylo/upgma.c,sha256=__7oKzcLWt0uMI8sS-X-ha4BPzknJQCFtk7l46IEuu8,1173680
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+ biotite/structure/repair.py,sha256=5tWFQVdw2SGENO0eQexe4Dni_bDpZdT0UfA59rDgJGo,7736
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- biotite/structure/__init__.py,sha256=DWftBI_fZjYUsHFdXhZI9TjqXtxHtkehwKq-Yh97iao,5277
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+ biotite/structure/celllist.c,sha256=X7hQV1cJelAtRhP8WDJHidqf0W4uvBPMIX4RnlVvAIg,1574606
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+ biotite/structure/sequence.py,sha256=s_ugDoGWYWTfUprxOOR-fv422qFkQFkOshLQ0yXXw4Q,4152
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+ biotite/structure/celllist.cpython-311-darwin.so,sha256=Hnc6mpikUPZrU7PGmc84DaJziLt81DzON-dAykyRZ7Y,338571
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+ biotite/structure/__init__.py,sha256=x60JjCz9II2kvycGwLHvdWMOKsF3Oqdy9oPbqXMskuU,5323
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+ biotite/structure/charges.c,sha256=wMaSEPNolWJczy5YiUN-y4tjt4IAhIGFPKj8xH1_UXo,1415318
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+ biotite/structure/bonds.cpython-311-darwin.so,sha256=pukmZ1HTgFgLOya52JxIXodM1R8E9mMOYrRwEd2_HM4,599976
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+ biotite/structure/charges.cpython-311-darwin.so,sha256=tXuYdok4OVLDEbmhxwa26pBy4cVe05S9qiA5aOLll9Y,283658
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- biotite/structure/sasa.c,sha256=3bCfivVoCKVudUxroMdSRRIqmQiiZHlmkNUG8eILBcg,1327338
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- biotite/structure/integrity.py,sha256=9XndLoDGyOxB6l16to5mv4sGyUyRTb2PxD_hxxPk_ec,10061
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+ biotite/structure/sasa.c,sha256=RZ6orGqKIIfF2YV09W4WM8Ebex0ZuzHVCHEaArjZgEU,1327338
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+ biotite/structure/io/pdbx/bcif.py,sha256=u4F5FxpGIA0jR1gaG_SRGJNlLjHSo-xzueBcHfE_ukE,20379
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+ biotite/structure/io/pdbx/convert.py,sha256=jrBqyx5vEnZLr81MXeZxjHrubmGzph3KNKYQm6c2Eyc,59757
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+ biotite/structure/io/pdbx/__init__.py,sha256=2rl6Fn2aPcu8-2QtgIVzjCOPVdvCWfqZh3LJr43TUP8,714
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+ biotite/structure/io/pdbx/cif.py,sha256=OuL9csoC1BsyMutILRnPL433LPvNxcTwnJcv-RzLpao,32437
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+ biotite/structure/io/pdbx/component.py,sha256=vS_aicTCme52-nqfjJPz4ZhKhbBZYHU7kOVLUOU7ypA,8143
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+ biotite/structure/io/pdbx/encoding.cpython-311-darwin.so,sha256=IowTJhrAzPURYZgNHAG0maIgt3Ba9zNWpktaMmV_d-4,1157739
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+ biotite/structure/io/pdbx/encoding.c,sha256=BQG00oLrMHHU595Xjlo5HQ0zk4R-4ARRBjxDAG1SUJA,4736141
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+ biotite/structure/io/gro/file.py,sha256=AEmYhsl1ieO1OJ1sg4pSCDt2j9Iguurnhn-aFCqAFCM,12800
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+ biotite/structure/io/mol/header.py,sha256=l-1vqEEnxgJ6KhWFfkf3xATf-SETOERB-apS_npFnwg,3381
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+ biotite/structure/io/mol/convert.py,sha256=vPS3ZzbVX9qpWj4f5lz0_XtZ_GW6WkBJMfcqCbC8eYM,3781
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+ biotite/structure/io/mol/__init__.py,sha256=fuqvVcydfrxekEsU7qAQ2Zb9sYX3vfQ1uygG20wJNZg,581
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+ biotite/structure/io/mol/ctab.py,sha256=retJO8KrIgpg9FxjvrRnCeI6BwqYo43Duh2Kfv_B2Ik,13532
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+ biotite/structure/io/mol/mol.py,sha256=_55esbURwK1sNWkSopDR6WOpOOPdGXwaDW74_-pWrgg,6293
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+ biotite/structure/io/mol/sdf.py,sha256=IsHlF2JADsu_18tdhRlaXxYdJUE0TMgceTG-jGv-QuE,32006
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+ biotite/structure/io/pdb/file.py,sha256=9dhv1uEApagyZsBKC1_yr0ARy8hfEnW5eJMpHX78-YM,48003
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+ biotite/structure/io/pdb/hybrid36.cpython-311-darwin.so,sha256=cTawfgSDfQMSZHF-t5McMnPC8HdmVtbCHrk62if3ask,211611
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+ biotite/structure/io/mmtf/convertfile.cpython-311-darwin.so,sha256=I-7RdBwIjDcDPpmiFR7auk4iFEYIpV5BOWO_IDD5otY,355470
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+ biotite/structure/io/mmtf/encode.cpython-311-darwin.so,sha256=kFPpdaOc1CjF312eGAXX9LeNYP5PqYFA-cwzjfNcmLI,262137
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+ biotite/structure/io/mmtf/decode.c,sha256=2_eoCIpwHnTj1uwhGnuhuY_yHncH6sSy1AcAslS-Ajk,1384593
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- biotite/structure/io/mmtf/encode.c,sha256=lM7_UCbFNG-YKYuvAJ_J_LOq-cYtwKgze2WFgiizN6w,1332417
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- biotite/structure/io/mmtf/decode.cpython-311-darwin.so,sha256=6Wba14Ki_pGeXLyKrM0Npn6TPeScOOCuEiUGMY3rgL8,282313
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- biotite/structure/io/mmtf/convertarray.c,sha256=8Hpwk4WPmgGmAMqTKfA8TCIRKsvOYjmDCs7GkmHYA6c,674749
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+ biotite/structure/io/mmtf/encode.c,sha256=sLMVnFjPafY3NssorbDc13ktibeNe9gXXpSFQytxnpA,1332417
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+ biotite/structure/io/mmtf/decode.cpython-311-darwin.so,sha256=REG7JFbXfSGNu8dXpxTim__xLFBzY26fPlJGLdSZYFY,282313
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+ biotite/structure/io/mmtf/convertarray.c,sha256=t6qV11WmYGEijMxhHiOX5VK8AayCt7-jY4sUtyb8INk,674749
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  biotite/structure/io/mmtf/file.py,sha256=mMNUCXx6cKptqqcfteE_2i-e_PPwDAyVFLebZnvoQS4,6946
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  biotite/structure/io/mmtf/assembly.py,sha256=HYVy2Knir1TqWT_NfvrmUmR2UX8eFNzVmQImSLZP-7w,8184
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- biotite/structure/io/mmtf/convertfile.c,sha256=aPA5wXRMtA-q5Z8LuuRZmSr35FNR3cZqfS5Q1uqthqc,1553893
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- biotite/structure/io/mmtf/convertarray.cpython-311-darwin.so,sha256=DbT9uNX7lKWSHk_14iXtJOScsZRLWkV2aR2-z3sFAwk,194815
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- biotite/structure/info/misc.py,sha256=MLYXpMlZRig9-gk-8fy5k10H7T0stpKnQ3h9uDMxNMA,1841
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+ biotite/structure/io/mmtf/convertfile.c,sha256=SAFMnBcdlYD8Q-bMIDTvCdSegCGZROOKm-9viPfougo,1553893
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+ biotite/structure/io/mmtf/convertarray.cpython-311-darwin.so,sha256=eDRvM-KzOnKtncsgd0cA431NoVwkUeF1PX-EkVlbEsI,194815
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+ biotite/structure/info/misc.py,sha256=bmG6nycH8s49lAxEwMVnNLCIz95VMCR1EIDQeVyWUyo,3490
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  biotite/structure/info/atom_masses.json,sha256=WME4ezDPy-HrEIhxkOGxcmIMdgxf1x7e_xwBkFRdTsY,2383
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  biotite/structure/info/__init__.py,sha256=k57tfM03apKfR3UlJMoDXZHS6jilhkeni1DoQa_nWLs,702
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  biotite/structure/info/groups.py,sha256=RTJvSclZGxQkcsOH6ML43QWCBkeUQKE4eNSge8MHgPE,2043
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  biotite/structure/info/standardize.py,sha256=AaYn7mx6Y6NylkeOg1kIpyNoI-KrWbGSXXu_GEcSAZw,7772
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- biotite/structure/info/bonds.py,sha256=h32B-0-4zEs9e_ZrGyIXP_Rp4IXf6u_Cm0k-DgbC5pI,4644
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+ biotite/structure/info/bonds.py,sha256=YDcRf480_M_Sl7j3uoZ7aJZbpfAg4n6tyVoD3ijFtNk,4651
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  biotite/structure/info/masses.py,sha256=dnZbg4k_89SuTwFUulyTKAL6Mnk4POPMIVhJLl5xswA,4489
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- biotite/structure/info/atoms.py,sha256=3a_Cp7sRKwRq6rzl1uvX9Ak1fzTzLdZdJdx4zXx_1JM,2427
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+ biotite/structure/info/atoms.py,sha256=qPCAgGF1Rd6e7mIzyBmXF1zMZy6pgX8E3wDeDvC1asU,2568
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  biotite/structure/info/ccd.py,sha256=26BnKJEGH6Bhmvkll_ev6HSCIi0hNx_cs_N9hqNXP-4,2754
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- biotite/structure/info/ccd/components.bcif,sha256=2exbF1n0jReJ3JTI9YYPzjxCtrIu3Z6myll-w3JOQRU,35086693
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- biotite/structure/info/ccd/amino_acids.txt,sha256=AC0v3vCBdzSzC0nQZ_jCXGviuBi_9PHUGqLe_regyMY,6591
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+ biotite/structure/info/ccd/components.bcif,sha256=xgvErxils9GNg5s0sGI33B7w4lWeUBZRksPer3japnE,35649254
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+ biotite/structure/info/ccd/amino_acids.txt,sha256=RUyolncqbsplkY2hlajjOSciigyZEYL1GCx_f63jXx4,6669
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- biotite/structure/info/ccd/carbohydrates.txt,sha256=2rAtgJ4vu_SPY_3dZOZkioBXs4lDPPY8FKfINPStFmk,4532
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- biotite/structure/info/ccd/nucleotides.txt,sha256=x02Y7eWP4JiR-Fw5qXltSUd-UbTQxNWuQUjr67f46RM,3132
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+ biotite/structure/info/ccd/carbohydrates.txt,sha256=bh5Vc84tETB-FKUm6H1brBN6zM5a2zzzwuWyb0MXaLA,4544
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+ biotite/structure/info/ccd/nucleotides.txt,sha256=Q7Zjz45BAO6c2QDAgvYdKtWAqmjQxy2NQ6r-bsZRqv4,3136
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  biotite/structure/graphics/__init__.py,sha256=YwMT8-c2DjrkcwyK6jPeDtAKxQda0OhElnwk8J0y3Hc,353
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  biotite/structure/graphics/rna.py,sha256=bhIHoB_9sFuZPrHQ8qQnToRiTCfgQ7JLVNIdsQVvkw8,11888
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  biotite/structure/graphics/atoms.py,sha256=nMhbmnjytxEDkxTTm2wHM2dObSw3izjvRbqssCW876E,8171
@@ -1,14 +0,0 @@
1
- # This source code is part of the Biotite package and is distributed
2
- # under the 3-Clause BSD License. Please see 'LICENSE.rst' for further
3
- # information.
4
-
5
- __name__ = "biotite.structure.io.pdbx"
6
- __author__ = "Patrick Kunzmann"
7
- __all__ = ["SerializationError", "DeserializationError"]
8
-
9
-
10
- class SerializationError(Exception):
11
- pass
12
-
13
- class DeserializationError(Exception):
14
- pass