nmrgnn-data

View on PyPIReverse Dependencies (0)

0.7 nmrgnn_data-0.7-py3-none-any.whl

Wheel Details

Project: nmrgnn-data
Version: 0.7
Filename: nmrgnn_data-0.7-py3-none-any.whl
Download: [link]
Size: 29988
MD5: 15f9f956891de81c1d263951cf34c242
SHA256: be950491ecddf72f0ab4942acdf90742c033b3e21c077afa1f89413888e2089f
Uploaded: 2021-08-31 03:04:58 +0000

dist-info

METADATA

Metadata-Version: 2.1
Name: nmrgnn-data
Version: 0.7
Summary: Chemical shift prediction dataset
Author: Ziyue Yang, Andrew White
Author-Email: andrew.white[at]rochester.edu
Home-Page: https://github.com/ur-whitelab/nmrdata
License: MIT
Classifier: Programming Language :: Python :: 3
Classifier: License :: OSI Approved :: MIT License
Classifier: Operating System :: OS Independent
Classifier: Topic :: Scientific/Engineering :: Bio-Informatics
Classifier: Topic :: Scientific/Engineering :: Artificial Intelligence
Requires-Dist: tensorflow (>=2.3)
Requires-Dist: click
Requires-Dist: numpy (>=1.18.5)
Requires-Dist: MDAnalysis (~=2.0)
Requires-Dist: importlib-resources
Requires-Dist: pdbfixer; extra == "parse"
Requires-Dist: biopython; extra == "parse"
Requires-Dist: gsd; extra == "parse"
Provides-Extra: parse
Description-Content-Type: text/markdown
License-File: LICENSE
[Description omitted; length: 2563 characters]

WHEEL

Wheel-Version: 1.0
Generator: bdist_wheel (0.37.0)
Root-Is-Purelib: true
Tag: py3-none-any

RECORD

Path Digest Size
nmrdata/__init__.py sha256=kAjxPiJSwDTuHFcW01Sah5x5imbBdwp3zx2H_QWUbiQ 82
nmrdata/loading.py sha256=1KRfcjkRjT8SPoJjZGFOBhu8eRkxbt8i1uzY5H4O58k 14058
nmrdata/main.py sha256=eCQl0LNnHJfCTbzOyLZxDlo7_KOSs7FEEb3wihy5qXE 335
nmrdata/validation.py sha256=CtYl5JG3DmZdnZ39AhA8mmWVVD2nxAkZTL1tG2jMcd4 11502
nmrdata/version.py sha256=4Pmv3T11bvLiIG8bLbUNqedn6TR70yWeNqRljWuDofQ 20
nmrdata/data/__init__.py sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
nmrdata/data/embeddings.pb sha256=2uCK99sEy-78MiUkPD-J_aSvH8Wqmv1gAv_Ra1a7o9Q 8101
nmrdata/data/standards.pb sha256=1rYiapc6nAM908_1kGpMJ84Errexs-Ag8IK9YqmrFvs 557
nmrdata/parse/__init__.py sha256=aPb-E9n7DcsAOACgL0TmsxAZw45ZhxrXBV3OTX7n3xg 28
nmrdata/parse/add_dssp.py sha256=4E4eoTBb78u6_PwRt3BgPq-MiXcux9qEPM0eGwaMp-E 1851
nmrdata/parse/add_weights.py sha256=Okogk33_NHwmVLXJCTiv13Ax2GJRl3oU5sH3X6KWQx0 1817
nmrdata/parse/label_standardize.py sha256=XMERceTKt42Ls-q-zdaSKC5xIxtJTI0TxmnfPNXritM 1752
nmrdata/parse/main.py sha256=OtVcpt2zRCAcuxcpM8V8USP87sR_Vmvl71S5sAPt5Ic 1271
nmrdata/parse/metabolite_tfrecords.py sha256=eHH6xmJdplgW4qDJ_svMbYX1gA771GbvwDOH9CdpP8k 6808
nmrdata/parse/prepare_shiftx_records.py sha256=OEfuKThpJRCkgp7mkrqCgJNnH6-FkOIc41aNHpnizUg 524
nmrdata/parse/protein_tfrecords.py sha256=Qn0vAS0Z5VzTj0vT7y_BDAndcMmE23hcv8Fq7Zik-cA 19436
nmrdata/parse/shiftml_tfrecords.py sha256=QPZ5VgxB1I8i041t7t7O-M_6G0rvZGBmjj6fvn8B_6c 3509
nmrgnn_data-0.7.dist-info/LICENSE sha256=2S-HUXOKyCtOkjQMM0ePhdQh_Mi_rVrLPQXtCdKp5CE 1073
nmrgnn_data-0.7.dist-info/METADATA sha256=OSKF-62rKEJAY-fM4SZLXkPIfktGF1VoLnKdJSwwWaM 3460
nmrgnn_data-0.7.dist-info/WHEEL sha256=ewwEueio1C2XeHTvT17n8dZUJgOvyCWCt0WVNLClP9o 92
nmrgnn_data-0.7.dist-info/entry_points.txt sha256=6doXHYl8WJvTgNGGe-yM4l8RRNoup8I39PbYkr4SKsw 121
nmrgnn_data-0.7.dist-info/top_level.txt sha256=e5FnOvew744YBvCYetdWWKcJMzP4SQxWIYObVTftKuc 8
nmrgnn_data-0.7.dist-info/zip-safe sha256=AbpHGcgLb-kRsJGnwFEktk7uzpZOCcBY74-YBdrKVGs 1
nmrgnn_data-0.7.dist-info/RECORD

top_level.txt

nmrdata

entry_points.txt

nmrdata = nmrdata.main:nmrdata
nmrparse = nmrdata.parse.main:nmrparse

zip-safe