mollib

View on PyPIReverse Dependencies (0)

1.0.9 mollib-1.0.9-cp36-cp36m-manylinux1_x86_64.whl
mollib-1.0.9-cp36-cp36m-manylinux1_i686.whl
mollib-1.0.9-cp36-cp36m-macosx_10_6_intel.macosx_10_9_intel.macosx_10_9_x86_64.macosx_10_10_intel.macosx_10_10_x86_64.whl
mollib-1.0.9-cp35-cp35m-manylinux1_x86_64.whl
mollib-1.0.9-cp35-cp35m-manylinux1_i686.whl
mollib-1.0.9-cp35-cp35m-macosx_10_6_intel.macosx_10_9_intel.macosx_10_9_x86_64.macosx_10_10_intel.macosx_10_10_x86_64.whl
mollib-1.0.9-cp34-cp34m-manylinux1_x86_64.whl
mollib-1.0.9-cp34-cp34m-manylinux1_i686.whl
mollib-1.0.9-cp34-cp34m-macosx_10_6_intel.macosx_10_9_intel.macosx_10_9_x86_64.macosx_10_10_intel.macosx_10_10_x86_64.whl
mollib-1.0.9-cp27-cp27m-manylinux1_x86_64.whl
mollib-1.0.9-cp27-cp27m-manylinux1_i686.whl
mollib-1.0.9-cp27-cp27m-macosx_10_6_intel.macosx_10_9_intel.macosx_10_9_x86_64.macosx_10_10_intel.macosx_10_10_x86_64.whl

Wheel Details

Project: mollib
Version: 1.0.9
Filename: mollib-1.0.9-cp36-cp36m-manylinux1_x86_64.whl
Download: [link]
Size: 1038786
MD5: 197682c19ae7cfa6cacea32b84e9a385
SHA256: 5cc804f1de96ceb49d6a48c756154e998795e66811ed75ed02085df8f26f7ed3
Uploaded: 2017-09-28 16:42:04 +0000

dist-info

METADATA

Metadata-Version: 2.0
Name: mollib
Version: 1.0.9
Author: Justin L Lorieau
Home-Page: http://mollib.readthedocs.io/en/latest/
Download-Url: https://pypi.python.org/pypi/mollib/
License: GPLv3
Classifier: Development Status :: 5 - Production/Stable
Classifier: Intended Audience :: Science/Research
Classifier: License :: OSI Approved :: GNU General Public License v3 (GPLv3)
Classifier: Operating System :: MacOS :: MacOS X
Classifier: Operating System :: POSIX :: Linux
Classifier: Programming Language :: C
Classifier: Programming Language :: Python
Classifier: Programming Language :: Python :: 2.7
Classifier: Programming Language :: Python :: 3
Classifier: Programming Language :: Python :: 3.5
Classifier: Programming Language :: Python :: 3.6
Classifier: Topic :: Scientific/Engineering
Classifier: Topic :: Scientific/Engineering :: Chemistry
Platform: any
Requires-Dist: configparser
Requires-Dist: numpy
Requires-Dist: scipy
[Description omitted; length: 992 characters]

WHEEL

Wheel-Version: 1.0
Generator: bdist_wheel (0.29.0)
Root-Is-Purelib: false
Tag: cp36-cp36m-manylinux1_x86_64

RECORD

Path Digest Size
mollib-1.0.9.data/scripts/mollib sha256=ieQKfyiaZEn1ttQdx4Gt0IoqzO4Vu1IkPvJVRzx0Yu8 72
mollib-1.0.9.data/scripts/ml sha256=ieQKfyiaZEn1ttQdx4Gt0IoqzO4Vu1IkPvJVRzx0Yu8 72
mollib-1.0.9.dist-info/DESCRIPTION.rst sha256=opRhUuNbbNu0jkliZpzFv--Y9bEWskJwlqsMiCG1-ho 992
mollib-1.0.9.dist-info/METADATA sha256=45ls-DFGKi5ama-aZME_AaesbSCxOxaSGy-0v63Uhd8 1967
mollib-1.0.9.dist-info/entry_points.txt sha256=SbN5bMaBj5tK9eR9HJIf2FGbrMUebX71nThoncyWn3g 112
mollib-1.0.9.dist-info/RECORD
mollib-1.0.9.dist-info/WHEEL sha256=nd6vkSWs8DEKiyCL0EDgvNKKSV5WLkJz4DczUuxkLLk 109
mollib-1.0.9.dist-info/metadata.json sha256=mfUz-fZF6EcGIVumMMPBVPE9e7FiAnrRa03m48SFdXE 1343
mollib-1.0.9.dist-info/top_level.txt sha256=Em2oqPhix_KHHvp7-j3PLY2J5Hp9AZTig67qtbYg_bw 7
mollib/__main__.py sha256=A_mUbsl7WNEef7RdWkD6G3L8O-ub8q-qihVd2eY_eQk 4658
mollib/__version__.py sha256=ukDN5suOJ0cB4JPavlEut3esyQ3XLE1DE0WrPdMre08 1728
mollib/__init__.py sha256=5Qy1yJBBOMP32-sKRWOZR4zr8heVYhY3nCTGpLd2KqA 206
mollib/hydrogens/settings.py sha256=-yN0ICwkjtKClHneHMjcwggj67R8s1odFgqZF9Hedr8 665
mollib/hydrogens/plugin.py sha256=Smmib418UKWZKXW-P1n6QYiVakz4NNPpWTYQltJJgKA 1428
mollib/hydrogens/hydrogenate.py sha256=YZ87MwaGU0dCYcFya3gbEHxEIZsktqZ6-jM3rqDcjFU 31132
mollib/hydrogens/__init__.py sha256=R8NPYfJVUrs3Zn3Xko4FINBE98a3y5g587nkSKh0nBs 317
mollib/data/high_res_short.txt sha256=okrcKjQtvPqTfSYFkW0hqPjCNJffRAl41ZQhwI13Xbc 240
mollib/data/high_res.txt sha256=ZeBAW9XmWjBWAVLjF6Ga9gNXEjkmsquBBC3Ix-G2fzc 71322
mollib/data/ramachandranstatistics/alpha-helix__C-term.npz sha256=dEelu471jC7UVV7JYj-Uy4T852gogxRathzIQjr4pyI 43184
mollib/data/ramachandranstatistics/pi-helix.npz sha256=kCL_Y9wRrzb_g41Rw04EHXTVwGuOaO7iRmp5PzNrDIk 43184
mollib/data/ramachandranstatistics/sheet__N-term.npz sha256=iEb4_JKtCwS1nnuE8RucOD9a_LdhtF7UsZODkDFbrMI 43184
mollib/data/ramachandranstatistics/alpha-helix.npz sha256=jKpAv1sSKVvIvNiXFtScWCfff2Qk38LzMNIQB5owpAs 43184
mollib/data/ramachandranstatistics/310-helix.npz sha256=zfspUn3nELAVf-xuxpMe_p3mX-PAWcQbj-KeNYNFnoI 43184
mollib/data/ramachandranstatistics/alpha-helix__N-term.npz sha256=EuODkhba5JU9gpE8_JMJ4b2vc_pZTuQaZl3HSvsQkNg 43184
mollib/data/ramachandranstatistics/type II turn.npz sha256=1ckLyXuPRWFr8P5UCWP4mJk2aad38uxbEY605ZGt7gI 43184
mollib/data/ramachandranstatistics/type II' turn.npz sha256=MaXGDaY1BK4wzFtuV-QEgw4PkFyfbCTDIfVSnUd88zM 43184
mollib/data/ramachandranstatistics/sheet.npz sha256=bSSis-YxxaspOgszaaEmSIrT7VJEFLNYRLskMhnNmYM 43184
mollib/data/ramachandranstatistics/Gly.npz sha256=4pkpesV_7AeTbEGtpOxGK7KVVwT0nFC73Wkq-r4YMeE 43184
mollib/data/ramachandranstatistics/type I' turn.npz sha256=0Jy8SsejtTssYOBtX8bdg6Tx0KDIRmGOAZuSCpW-trY 43184
mollib/data/ramachandranstatistics/sheet__C-term.npz sha256=bXLFe8QP2PzpCQynD2zs1XgWlg-Xsi3ldGaksAedcnk 43184
mollib/data/ramachandranstatistics/No classification.npz sha256=1t3CX3U0dCtTZuwQGWIxZOPxP3BuOT7sJoFqaMGHwmY 43184
mollib/data/ramachandranstatistics/type I turn.npz sha256=Hkg_6_pdQGzdH_gGgXpBOUFG_VfzrezuGxRmdBE_ZgI 43184
mollib/data/hbondstatistics/sc-sc amide__isolated.npz sha256=4AO1T6xoH0QhO521b4FAab0xHUVitZd1ZTNxE6gtWaA 4682
mollib/data/hbondstatistics/bb-bb amide__pi-helix.npz sha256=tfQNthupap2TvnGi56J_Im9soJE57pAO01t6wsszjR4 4682
mollib/data/hbondstatistics/isolated.npz sha256=cGK-mk3tIs84S6Gktih0yXlnAJJEjyCMq-pdubMjr88 4682
mollib/data/hbondstatistics/bb-bb amide__type II turn.npz sha256=c0w6j6GZtKDmBLVAFHVjpTYesrnqhXYRmmtyJt1BQNw 4682
mollib/data/hbondstatistics/bb-bb amide__sheet.npz sha256=qol6iZ9TWBWQws6KDxrSHLsiA0apjhX4JmJptOAV1A4 4682
mollib/data/hbondstatistics/sc-bb hydroxyl__isolated.npz sha256=qR1DecVwy81PBERoig3KiWsVNIRZLHgkRVpFijHZKsc 4682
mollib/data/hbondstatistics/bb-bb amide__alpha-helix.npz sha256=iLASA_W7mx1IeKtviGA73jcNyJqqPK5K6M41BhMn_Pk 4682
mollib/data/hbondstatistics/bb-bb amide__isolated.npz sha256=bKHaLMS1nxbtzmQwPyFyQ7AAAy9RvTVEmv9yG99jPFo 4682
mollib/data/hbondstatistics/bb-bb amide__type I turn.npz sha256=RGnt4y7vbhHoxNhTIOL6s0-NwSkCjh-IPZIn0uioIPs 4682
mollib/data/hbondstatistics/sc-bb amide__isolated.npz sha256=WOrv6t489q_lEK3hFVEd9-l3t70bpXcPHmgdQ5rtrPA 4682
mollib/data/hbondstatistics/bb-sc amide__isolated.npz sha256=cZbhow17SfIGr7bx6Ztx9modDjpWNJMPyS27WgVkkjw 4682
mollib/data/hbondstatistics/bb-bb amide__310-helix.npz sha256=eCL5b9wZljXSgIEDzQMGoaj62o6jqwYcE_I5DFEN4iE 4682
mollib/data/hbondstatistics/bb-bb amide__type II' turn.npz sha256=NDhV_3PZIahz8k8tN_Nz5BVqiehOwge4CcFK6_TFMqI 4682
mollib/data/hbondstatistics/sc-sc hydroxyl__isolated.npz sha256=YjCFSJNaIo1r9-xkAi5yER-opKDzSGOEJaX48bZcPfE 4682
mollib/data/hbondstatistics/bb-bb amide__type I' turn.npz sha256=Kv1ayKyui2r_OPCVsecMIK3v_2FPCYeMwg6Y1U7V7SM 4682
mollib/core/geometry_box.pyx sha256=aF_FkAI6np1t2tbMu5B9CxAuFneB2VSP3uV2XYNO_jI 5539
mollib/core/chain.py sha256=X1RGlHg7BhxHVcnWyUmIJkXLfiEl-SdnoAfY4XUD7Xw 1901
mollib/core/settings.py sha256=qfB6HphCJixgJqJ83xSL2EJJ2CSGllKnMZ6OGU-_BDQ 1544
mollib/core/primitives.py sha256=a27mRMTBPZHqSyuftRh65oUc1S8TcADYzMAadJDV2ag 1326
mollib/core/utils.py sha256=HnNF-kgcgwrdHE-q1AU170AZ-_7FLaut-gEifH6R-Lc 6046
mollib/core/atom.py sha256=rESMIYcudzqY7QOebNWsRqPYE4HOIG3ckcrrf_bxqr8 19801
mollib/core/molecule.py sha256=6ucMHMm4vAjUvfJuOVX0m0qQNURzfItqUUeuwPL3yCE 38815
mollib/core/topology.py sha256=1V2CUZf6UGxepLnYL2vGhAd4w0UUv_UsX3X1hpj1S-M 14201
mollib/core/geometry.pyx sha256=h18Rz8yDk-LylCfOtGHIA8s9oLS6wROdXML055gREso 16212
mollib/core/residue.py sha256=wdFzElIXFUfP7XlTbwJXtAQcL8j-vTWzEA59TQf4Abg 9368
mollib/core/geometry_box.pxd sha256=Yzjp_6JPqw7t2noKGtbRaTGBsj3oQNi5QnUcah28JBk 525
mollib/core/geometry.cpython-36m-x86_64-linux-gnu.so sha256=ZEwYMCmsxOpsVHHaLZnpBQ2rW0WhkCFn0BN_n1K_WR8 1504419
mollib/core/geometry_box.c sha256=P1HNZm06_fIlCvgJbnq66J4prbH95xEyr925qoQE3HI 275715
mollib/core/geometry_box.cpython-36m-x86_64-linux-gnu.so sha256=3H6orN_D5nboo85jXHz4wSh2hfLrotee9v9f87otVII 432823
mollib/core/__init__.py sha256=z9ED7uhrWyX0DdNFVEavBLmvqsDqZahQ1KvvhdAPl4U 555
mollib/core/geometry.c sha256=II_Pq02JrJi2f5AM1OscQNxfmguZfFXOmsqGziUtAtI 1195243
mollib/core/settings_manager.py sha256=nvUZYe4rW-SYCMrMgF-y_58ZvMc06U2JY4LWI1XHAG4 5894
mollib/core/readers/pdb.py sha256=v_AFnQv_Beiw1nk-oRzqZ0SHU-e1H6amddWDwOTSPTo 13768
mollib/core/readers/__init__.py sha256=GXaHuwkJFHGUNNoztHW6ORBYXAupQIOVXRvQ45PJgrA 52
mollib/core/readers/base.py sha256=rQub7OdKMt7g778H69NfGUMuaCXUepzNfnPY-3XLaNQ 5622
mollib/core/plugins/measure.py sha256=p1ZCYA8RbgylKLsrqWNVfaHW8rnrdCRO-JpHuAZd3b8 10489
mollib/core/plugins/__init__.py sha256=D0T0gNn2oxuvaUXA8SOUGNiHrei8Wqnq-0q3MlI1Fj4 121
mollib/core/plugins/process.py sha256=PioxLPl7Yobhd5kbiV2z6jnn1lq3rvTp_f0PHj3TB24 4699
mollib/statistics/settings.py sha256=tXckQSNti_kcnaPvhxDFn-G0DCsIj-jNDU5xsfGvzpk 248
mollib/statistics/hbond_statistics.py sha256=ADZ3cK0c59gMcwAU45grpsp9e3l5CTtm8CDbDiVq4uI 4464
mollib/statistics/ramachandran_statistics.py sha256=yT3QAJzm5vRQbJAJOzG4-H-3ccVJyDRglHJ8-Flzbzc 4843
mollib/statistics/__init__.py sha256=rzfxxfxVod021QmIXwV43TbJ8P7dz2C6VnfqF-ubJIM 337
mollib/statistics/statistics.py sha256=ehvGORo9_rOvmIcgCtvdKltSPb-vhYt0VoyAFsnBQ5E 7882
mollib/hbonds/classify_secondary_structure.py sha256=P0-GDBSGul56GyaFPI3L4GyMl3-n4WTBi0n-TPzVTvA 21576
mollib/hbonds/settings.py sha256=O2wDgc-t6sTQU_HOGECVlo4nzfJugfOP9evr-2NukuY 7285
mollib/hbonds/hbond_table.py sha256=4_GhpBJ9O-XVL6I54VedqlH3UWNDo-hCf9Rn3rjoOkU 4415
mollib/hbonds/plugin.py sha256=1tZKtJ1NYLJPxTXVStkmm-HfHNqIvVU_BY7UiTw-Tx8 3183
mollib/hbonds/rama_table.py sha256=ZBL8L7VIgZIx60Gx1-EgqOZs8Q7yk9cTVdz1wuwg58w 3194
mollib/hbonds/hbonds.py sha256=14j-thDUWGuAT29ZjQJ-PYB5ZE-u-EQSDiHOwepOc38 19410
mollib/hbonds/classify_hbonds.py sha256=JbGxPhjCQxTvsaWju25Y5MRu9TCjEhs7TQwTRQkp_0U 14625
mollib/hbonds/__init__.py sha256=J2glVSO1EhYaB5jhuRdHqX7si8jArkem0-GKUB_WsX8 476
mollib/utils/iteration.py sha256=wX1r-4ckCJO3BkB5fXu9351QLhcFTWW1A9LQBBVHy6k 1177
mollib/utils/markdown.py sha256=EelClXdukrUXBTag8f0B7QCJQASTby_pYZ3BbZOYUVU 9910
mollib/utils/interactions.py sha256=F0XFGpXsGSUi7KSa7cfh4pQuHNCHjZL_UDgFvlz3F2E 22360
mollib/utils/exceptions.py sha256=I625ygdyxG105TqX0nmWfCs_Cb4HrofKRRswLwVPN0M 100
mollib/utils/settings.py sha256=CsgLYQalIwNP9lR9ofnOCuFHJVaQgSf_GUfEswJBwyA 477
mollib/utils/formatted_str.py sha256=LRodXsqu5shzx_qZTmvfba9h2vlFBaMWBa5dUKlwtJM 5254
mollib/utils/data_types.py sha256=zcURav_jVwveaozbrSj5z3LnljNP5vki8f1I4gB2OKM 774
mollib/utils/term.py sha256=o9NVUxM4C8tZX0KrCCVaFn7wtzdJYDkYrfQphebUVUg 449
mollib/utils/tensors.py sha256=Cp8uAYDF9dzHEi1DQnh7rSl0fd-hLsE45d-DrgvUZlk 4899
mollib/utils/checks.py sha256=2yJTH7UcqCIQ1fUCIWmGcmhEIQkMbWco1-oqnLRLyrI 2752
mollib/utils/files.py sha256=oZ2dz3KE-oUSdlxiSCjeAjBoSL7pj2RFeakp5UL-Usw 3203
mollib/utils/ordered_set.py sha256=xm45RTcAOG4wTa9pa5qg4wc8FIvQHZUoQKfNAN9ND6U 1747
mollib/utils/text.py sha256=dUG0AJ4HgKm4Lx3FLd8y4U67ejxRWXuJN2Dmoh1kSaU 1017
mollib/utils/numbers.py sha256=J1t-zWEvi1Yu0LcK0T9gEicmyzOonhm2xJ0tqCONanc 476
mollib/utils/rotations.py sha256=IJO8Ft47vo3O5el7jl5j8rY7vNBUaehAipmqeEDSbxM 4760
mollib/utils/net.py sha256=9VOYY_p373Z7kSi2BPh4bWxVVOufgQUMVt-Tzj-oyWg 6165
mollib/utils/__init__.py sha256=op_bpIvYbprjzpL5G4af3ghYjV2TVZUVP-5P83A7LLU 229
mollib/plugins/utils.py sha256=Vzt9Og2fKqoiDMXIxvD2XcN07LR3j54_sK_keYjgb7o 2186
mollib/plugins/__init__.py sha256=b_WWZ05q2zmlP-fvkT05toxohiM49biEU_pzsg9ru5I 81
mollib/plugins/base.py sha256=KW5rvxrV1ILdgwqTMqFqNsYe3YCHV4VALUiIxe2FT2Y 5165
mollib/pa/analysis.py sha256=ORYhNAPc4iO3NFxil7__hxM6ASIJYrIatrgrz6Y1YIE 12790
mollib/pa/settings.py sha256=VroemPP_bOL_Gac4-U3X_qssogMSkSm93qI7B-3rajA 4470
mollib/pa/data_types.py sha256=z6uYAdstdUkWxn49oTG_SWC4cVY-TT1KDtoCyOidmV4 224
mollib/pa/utils.py sha256=7nxIKbCnBvDj46B-jB7D0UBqwofYiE_ir1cQCEIGF78 263
mollib/pa/plugin.py sha256=-zyLK0GxQUyJdVEkCnP1CfeZIPUPUa9u5rLHXITN0xg 10776
mollib/pa/reports.py sha256=g6h45Wrw3VBaQIJ6JY5lA2FvbeVyLovm6dZjsYYi8IQ 4286
mollib/pa/svd.py sha256=vazvKz7Zt9uxKoBZ0sHXoO8d57X1XwSiE_TjswVZcTQ 9316
mollib/pa/data_readers.py sha256=wvUtet9qj8L2nTojDsrmY1v6N33ZhHBiMj-9Bv2-CIs 13424
mollib/pa/logs.py sha256=-m36dZRdV_3yUsXP4aLmQ5i7CTySgGEL0n9FQYdQep8 94
mollib/pa/__init__.py sha256=7ipUATl04GRKScJWaZqHC1dnMMmuieU4rvWqG6vdofM 790
mollib/pa/process_molecule.py sha256=G9JWiPbbIE8fL9amBwUr4jxc29bNhBeJeqbyGrx6jYE 21258
mollib/pa/fixers.py sha256=MzSADzokfcNHHrjHRD0cnQUXeUFeugUrjCwFGThCUDI 11110

top_level.txt

mollib

entry_points.txt

mollib = mollib.__main__:main
build_data = mollib.statistics:BuildData