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0.0.106 nerrds-0.0.106-py3-none-any.whl

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Project: nerrds
Version: 0.0.106
Filename: nerrds-0.0.106-py3-none-any.whl
Download: [link]
Size: 39650
MD5: 4151615610c86d0dff920010fec53e3b
SHA256: 2f2243862c69becb683e9a7b93671bb94c6d180d5cccc35205ea525b67e9b4d3
Uploaded: 2022-09-04 16:00:11 +0000

dist-info

METADATA · WHEEL · RECORD · top_level.txt · entry_points.txt

METADATA

Metadata-Version: 2.1
Name: nerrds
Version: 0.0.106
Summary: NERRDS uses backbone chemical shifts to generate an ensemble
Author: Nick J Fowler
Author-Email: nickjfowler0[at]gmail.com
Home-Page: https://github.com/nickjf/nerrds
Project-Url: Bug Tracker, https://github.com/nickjf/nerrds/issues
Classifier: Programming Language :: Python :: 3
Classifier: License :: OSI Approved :: MIT License
Classifier: Operating System :: OS Independent
Requires-Python: >=3.6
Requires-Dist: numpy (>=1.18.5)
Requires-Dist: ansurr (>=2.1.2)
Requires-Dist: pandas
Requires-Dist: scikit-learn
Requires-Dist: prody
Requires-Dist: pdb-tools
Description-Content-Type: text/markdown
License-File: LICENSE
[Description omitted; length: 7639 characters]

WHEEL

Wheel-Version: 1.0
Generator: bdist_wheel (0.37.1)
Root-Is-Purelib: true
Tag: py3-none-any

RECORD

Path Digest Size
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nerrds/bme.py sha256=eLufhlARCWB3RBPPS4bqV6ev9Xafagb7U3-X2Fra3e4 3612
nerrds/functions.py sha256=86KWQGjs2HeL7q-pG_xn8ahEf0WWCBnCmE3tdb6OKqU 181
nerrds/gen_conf.py sha256=gl21wviqIaq_k2WUGmJJWKQnaMbQq-dcssA6Shljvdo 3161
nerrds/nerrds.py sha256=lNA0DOy09LHo1FQ5LmLAAEdNHOiawDbM0N6GZHFMHnI 12220
nerrds/refine.py sha256=7VxUQy-_0NA5Oai1Zva3-1l6E7Ia-Gj6uuQ5XigJlzM 6707
nerrds/reweight_bme.py sha256=8mIzM8LHKakCOp_AsWKvJKkKs6N8B3rhpZ-eNPfMrr8 5894
nerrds/run_ansurr.py sha256=AXSHGgN7Ry5xwBQ-J9vESyrpW6zPnJASTH4f0ldA3lo 1293
nerrds/scripts/__init__.py sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
nerrds/scripts/AMBER/__init__.py sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
nerrds/scripts/AMBER/extract_pdb.cpptraj sha256=vYptkA0luxwMJCRud94nBYJ9BAPZm16OWafafgo0U40 114
nerrds/scripts/AMBER/leap.in sha256=9lIWPOc_RAUzl2SZIiH9Hx-Cjeysl1TmCSPyfHLGj1s 242
nerrds/scripts/AMBER/min.in sha256=iKlH2QSfajHPrbF8djfVIDDT2BmRR6E4K-sfMzSDP3s 161
nerrds/scripts/AMBER/min_solv.in sha256=gMBnYpuEQfTavawvnCVq8UeUAuV39gwLUAwDim5AUHg 258
nerrds/scripts/BME/BME.py sha256=zksRzs2TgtjA2Tq5I-MnjjObwgbfL1dIO1swnW5csGQ 29043
nerrds/scripts/BME/BME_tools.py sha256=cYPcOgHxgiAFffxyMmcrYangDNfqvfc_r4yguzdl_48 12706
nerrds/scripts/BME/__init__.py sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
nerrds-0.0.106.dist-info/LICENSE sha256=OXLcl0T2SZ8Pmy2_dmlvKuetivmyPd5m1q-Gyd-zaYY 35149
nerrds-0.0.106.dist-info/METADATA sha256=NbSckFcDw7IswEEe-5fN4AVUBOOO3MlJLykEzq8jpDQ 8330
nerrds-0.0.106.dist-info/WHEEL sha256=G16H4A3IeoQmnOrYV4ueZGKSjhipXx8zc8nu9FGlvMA 92
nerrds-0.0.106.dist-info/entry_points.txt sha256=ZqyOaE7kg6Gqti0QJm1jqLCbFk7nOCRymro5scmHgvE 46
nerrds-0.0.106.dist-info/top_level.txt sha256=VwcxF8tpNTa0IbouVzySKo8SqzOlc099yAc2pGnjQJw 7
nerrds-0.0.106.dist-info/RECORD — —

top_level.txt

nerrds

entry_points.txt

[console_scripts]
nerrds = nerrds.nerrds:main