Wheelodex » Projects » dflow-galaxy » dflow_galaxy-0.1.9-py3-none-any.whl

dflow-galaxy

View on PyPI — Reverse Dependencies (0)

0.1.9 dflow_galaxy-0.1.9-py3-none-any.whl

Wheel Details

Project: dflow-galaxy
Version: 0.1.9
Filename: dflow_galaxy-0.1.9-py3-none-any.whl
Download: [link]
Size: 1798422
MD5: 74651420e7dc34e0f54d85f705ccecb5
SHA256: 62ba2b79c29d4614488688b8a9a7fd542c89d2afc6ac2d84cf5e23e3685cfbe2
Uploaded: 2024-05-13 06:48:33 +0000

dist-info

METADATA · WHEEL · RECORD · entry_points.txt

METADATA

Metadata-Version: 2.1
Name: dflow-galaxy
Version: 0.1.9
Author: weihong.xu
Author-Email: xuweihong.cn[at]gmail.com
Classifier: Programming Language :: Python :: 3
Classifier: Programming Language :: Python :: 3.9
Classifier: Programming Language :: Python :: 3.10
Classifier: Programming Language :: Python :: 3.11
Classifier: Programming Language :: Python :: 3.12
Requires-Python: >=3.9,<4.0
Requires-Dist: ai2-kit (==0.18.3)
Requires-Dist: cp2kdata (<0.7.0,>=0.6.6)
Requires-Dist: dp-launching-sdk (<0.13.0,>=0.12.0)
Requires-Dist: dpdispatcher (<0.7.0,>=0.6.4)
Requires-Dist: lbg (<2.0.0,>=1.2.24)
Requires-Dist: pydflow (==1.8.60)
Description-Content-Type: text/markdown
[Description omitted; length: 2010 characters]

WHEEL

Wheel-Version: 1.0
Generator: poetry-core 1.8.1
Root-Is-Purelib: true
Tag: py3-none-any

RECORD

Path Digest Size
dflow_galaxy/__init__.py sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
dflow_galaxy/app/__init__.py sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
dflow_galaxy/app/common.py sha256=LzvEaQMi6XvHLGa23fgqeMzfB-leu2C1xEqaHtYL85c 2499
dflow_galaxy/app/cp2k_lightning/__init__.py sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
dflow_galaxy/app/cp2k_lightning/dflow.py sha256=qfRZz276cFUXx_lU1yruFB7r41wJUG5MFAHUx1cqGuQ 2211
dflow_galaxy/app/cp2k_lightning/main.py sha256=OxxLFR52kxBiAdA4ud5yJHQoSF0UYkuKMn7cD1YeMso 7076
dflow_galaxy/app/dynacat_md/__init__.py sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
dflow_galaxy/app/dynacat_md/dflow.py sha256=3n4Weh5CwwD37a9XOZhh4hMHs-DvYHBVqB6a74jNto0 2050
dflow_galaxy/app/dynacat_md/main.py sha256=_MsrBsC1vferwA7N3Edg6rmOZ7ONeiTU8FsucK1OfvM 4853
dflow_galaxy/app/dynacat_md/report.py sha256=Q_DRq34pW4TNcvLrfSoLk9y8UqSuCE62T8XQVtY_Lno 2525
dflow_galaxy/app/dynacat_tesla/__init__.py sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
dflow_galaxy/app/dynacat_tesla/main.py sha256=bRZv9Wgmhqup2wiNkja9JgF9F-MZeBV84U8PvyK0jbo 16371
dflow_galaxy/app/dynacat_tesla/report.py sha256=NSKEogyn33vOs7XplPL_vV1_K7lXj_mY3S03WKIIc1Q 5892
dflow_galaxy/core/__init__.py sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
dflow_galaxy/core/dflow_builder.py sha256=DbEeyHHN12awmsDrYrAUVUN-svPlmbWwNLqix-KnJX4 29475
dflow_galaxy/core/dispatcher.py sha256=fgPGJLSREBUcmULjZcsavQZ_jd3uhS_aPQHxsIOEY9k 4687
dflow_galaxy/core/log.py sha256=ZjNQv3Mne-iwGhmk5Rz0-5fO6ofD4j-3JSPMosG8eo0 163
dflow_galaxy/core/pydantic.py sha256=oBbKMLFLfOGqzMlLZ3xf3WKyp1U5AJIwSAsDVVwpvGs 97
dflow_galaxy/core/types.py sha256=2gcdBBIsxhn2NfO9KLb_QAPXYWujta6dm5Hf5DlFXHo 541
dflow_galaxy/core/util.py sha256=hLQkbFgzJRGIx1qobir4X--lk4Wr3LtiGCVu2Tm7FqM 6065
dflow_galaxy/main.py sha256=6S78huy9DUwQ0D5n4Ya0AjNoGGLLzTg4gPnacO22jTw 335
dflow_galaxy/res/__init__.py sha256=3F2VtKnGPzzgRAVPPwMq1GEfa97el_VbwzcSNeCgbSw 146
dflow_galaxy/res/cp2k_data/ALL_BASIS_SETS sha256=ItjZFcgdjgo_Rx3Y22R3-UmERfDbuTQcZ_ijB_Y56IM 189331
dflow_galaxy/res/cp2k_data/ALL_POTENTIALS sha256=0rDJltG6BTFxBXQZm38Ma9-oXiCC7VCGIk4I7yysf3k 2717
dflow_galaxy/res/cp2k_data/AcPP1_POTENTIALS sha256=UouWU_NgiHBvWCvM-vJoBL43Dy9H6AF0Te1jVHPZv4E 15836
dflow_galaxy/res/cp2k_data/BASIS_ADMM sha256=5e-GgSSlL4evHTY3em9uw3m8yJncYjvUYxUpjh18inE 57524
dflow_galaxy/res/cp2k_data/BASIS_ADMM_MOLOPT sha256=3kV6pYQ0TvbrmVo7AHKCRR4w1jq4Y2mvACvHGPhAXMk 189911
dflow_galaxy/res/cp2k_data/BASIS_ADMM_UZH sha256=Pwhpn9FqeeEW3mX3Ug2zYvcUaGV6teHJDHNfpJMDk8E 133011
dflow_galaxy/res/cp2k_data/BASIS_ADMM_ae sha256=sgx6O6REuiVm7e5bzUxVWItOiCBdA-XYqhzwTFvAHhs 66934
dflow_galaxy/res/cp2k_data/BASIS_LRIGPW_AUXMOLOPT sha256=xhGJhjsysOs0mf4Z5vbhjTHokbxjdNM7nmUtAV9LneE 17509
dflow_galaxy/res/cp2k_data/BASIS_MINBAS sha256=ZgUgPFJeBqdegha0cqx-hZYh9Iq-mzUJ7i26Utzc2Zk 244853
dflow_galaxy/res/cp2k_data/BASIS_MINIX sha256=3wja0kPqh3QHCQNNS58FWtr7qLUkLBBDkWF6C_-ep8k 49588
dflow_galaxy/res/cp2k_data/BASIS_MOLOPT sha256=aG3XLnYB7kHUoXPkx8OUbx51DwMJUJD0TTghwYCoGmE 127679
dflow_galaxy/res/cp2k_data/BASIS_MOLOPT_AcPP1 sha256=iEikH9_DTiDTYB8qx53lyXTS8c6EzyeTmcHxuQaPF9k 55644
dflow_galaxy/res/cp2k_data/BASIS_MOLOPT_LnPP1 sha256=oWwgxl6ljxUlGyxj-td1zqArXNryJZ9Vy5FK-FVwOo4 23527
dflow_galaxy/res/cp2k_data/BASIS_MOLOPT_LnPP2 sha256=MDTtL6JooxybIi9cCCoHXPxRTc7p6n3AhhiaIZHM4nA 65485
dflow_galaxy/res/cp2k_data/BASIS_MOLOPT_UCL sha256=cXicQDNitAcvR-fruMvIniFaPtpdVAWerVl86_ll5BM 179850
dflow_galaxy/res/cp2k_data/BASIS_MOLOPT_UZH sha256=DaabhPSvmfdpKKn4PnI0V0-340e7200C8CGO4-M0njA 1574370
dflow_galaxy/res/cp2k_data/BASIS_PERIODIC_GW sha256=7CruS-7MA3B6LNEg5jQMO8ElQ267GOLwsd9iZg9pHc8 6644
dflow_galaxy/res/cp2k_data/BASIS_RI_cc-TZ sha256=zkQWB2ldxHN6JCDkvVd5DghZHIrYQGQBlzGydWVgYz8 37261
dflow_galaxy/res/cp2k_data/BASIS_SET sha256=HWDWetXyIlMYX9qdJ7I1WFIeBKKwxe-rr0SjP-IggYI 195109
dflow_galaxy/res/cp2k_data/BASIS_ZIJLSTRA sha256=ilrniYx_MH2DcGtFHKMJ6Zpw-HvnEiBNxZ-ErwoQ4ek 5526
dflow_galaxy/res/cp2k_data/BASIS_ccGRB_UZH sha256=YCMYLzEVuU14qj5ql055VfLFmUZgWyZ7EaFxT60udnI 324291
dflow_galaxy/res/cp2k_data/BASIS_def2_QZVP_RI_ALL sha256=rrVMCuAZ5TRz6R9ZIEv4tzPJrcwTysHC7T0k-q5JFuI 258169
dflow_galaxy/res/cp2k_data/BASIS_pob sha256=aOSD3uTZo9doy79dSk9fYsrVchmoQJPDEgedDwmCm-0 191314
dflow_galaxy/res/cp2k_data/ECP_POTENTIALS sha256=2peyykjieBLaUuRmRzeShX92fxMcL9WomlBTlysjuc8 223481
dflow_galaxy/res/cp2k_data/ECP_POTENTIALS_pob-TZVP-rev2 sha256=esv504u8QQIAd7uu7cIXGtx8V4DswhG8vMp6MBc8bYg 23668
dflow_galaxy/res/cp2k_data/EMSL_BASIS_SETS sha256=bx9LG3B1g-ASmhScVCIaYzoDkTL3h-XfPSCP9ugYLYQ 1713484
dflow_galaxy/res/cp2k_data/GTH_BASIS_SETS sha256=dtHM1SBDkKv8retcDV5gn_PRUcHBpYOgI0mvNI75Gfc 119403
dflow_galaxy/res/cp2k_data/GTH_POTENTIALS sha256=pDBxFbrNqiU-D6oks_n3unwdxgWFy9g2kcZf9R0Nuf0 167483
dflow_galaxy/res/cp2k_data/GTH_SOC_POTENTIALS sha256=K09P0J61hP_H0WmdczOB291xXgGMzMR6AZV08qyE_iQ 253677
dflow_galaxy/res/cp2k_data/HFX_BASIS sha256=t9dlwyJjqueTUYg5z_PaxDQwmAD1J3xTmFHbtE7ZGv0 17275
dflow_galaxy/res/cp2k_data/HF_POTENTIALS sha256=Of3eWDIFVkwPYPUyxESId4SR2MCrGRrLTct-0oVzfs0 2106
dflow_galaxy/res/cp2k_data/LnPP1_POTENTIALS sha256=PhEBf-LzpQA06GMyhhnFkd_o7kKOCNiwUIfv4vg1W20 5486
dflow_galaxy/res/cp2k_data/LnPP2_POTENTIALS sha256=oHsSshlPHKLTIpedvlzFW05F-CZWT_nK7sn0LB3vgEg 7829
dflow_galaxy/res/cp2k_data/MM_POTENTIAL sha256=TOemI1-XvAKF220A9YMaeLTjzhCLeAlrWujK5hCvQTA 447
dflow_galaxy/res/cp2k_data/NLCC_POTENTIALS sha256=JnGmyeh6pWZuWu4lxFRSwmRza1rnzr3ukylkANWTMGE 5498
dflow_galaxy/res/cp2k_data/POTENTIAL sha256=6vVWUWrSDl6xRFJGBBNewAPqDwL4gVTetW9EJnvrb_k 177804
dflow_galaxy/res/cp2k_data/POTENTIAL_UZH sha256=f9aUKmJ8fRqJfZOOGY6jyTBjCsmNPnCZQmvYNZbGt2M 385325
dflow_galaxy/res/cp2k_data/README.md sha256=Mu_6n6ZqVd1DQI67n0jyyAk6w5dTpL3K7X5hu7D5BdE 125
dflow_galaxy/res/cp2k_data/nm12_parameters.xml sha256=2-kBEHPlUgtJQdla2hEqiVyGTsJzRz5c0CueXZw3hcI 91811
dflow_galaxy/res/cp2k_data/xTB_parameters sha256=2fEfpkEdIDE12IohF4-KhzU0Sdw9FRtCzpcnBU3I-kU 32194
dflow_galaxy/res/dynacat/deepmd.json sha256=slxsyY1XtjH8CizE0OUYAUiUIJioNbwZuBGJgDdlygw 1128
dflow_galaxy/res/dynacat/tesla_template.yml sha256=L9bCws8vrJxYrK6ybxwq0txE23NXvFkj7ONgioVZp5g 1171
dflow_galaxy/util.py sha256=sWr75zhNa6-y1DQKjR0nshceebE5bwUt5SklIfEzroA 906
dflow_galaxy/workflow/__init__.py sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
dflow_galaxy/workflow/reweighting/__init__.py sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
dflow_galaxy/workflow/reweighting/domain.py sha256=ZAfqxceo7imKwM30gnmu5qdAVDeocGwtxa5hL10yO_A 1172
dflow_galaxy/workflow/reweighting/main.py sha256=tkFKCz5R0YC0CsqxczOd7S-rCz-g_uxdA7Ld4sQbnyM 1255
dflow_galaxy/workflow/tesla/__init__.py sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
dflow_galaxy/workflow/tesla/config.py sha256=I8HrEr4gFezTBFHHGGz_UjoXk2x-Rl_iPMQXVI4-mD0 1702
dflow_galaxy/workflow/tesla/domain/__init__.py sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
dflow_galaxy/workflow/tesla/domain/abacus.py sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
dflow_galaxy/workflow/tesla/domain/cp2k.py sha256=_qeDh9tv7qHZzL1HSU5D2ffJYbgB9g5NB9HtdrjE9Tg 6347
dflow_galaxy/workflow/tesla/domain/deepmd.py sha256=44VdAWP1K3NwYZ9MzH8wIcbQclzXrqjDCEXTd1IcQmg 9700
dflow_galaxy/workflow/tesla/domain/lammps.py sha256=9QDqk9K9pNy-eiN91HGe8hkypUFRJ6ZzJJv7zep4M5Q 8065
dflow_galaxy/workflow/tesla/domain/lib.py sha256=EPhHrS7GZM_TzyQOkcN78GKK5Sb14V-iGuMyo47tncg 1261
dflow_galaxy/workflow/tesla/domain/model_devi.py sha256=AhKW2BFHYcuVNDJesnTi-pGVWtMH_o2DeZIzdA4Qjxw 6342
dflow_galaxy/workflow/tesla/main.py sha256=zdFZeXNwOD9obYzsKL_qCAuVwdiV0T-yX83n5P-e8cU 8193
dflow_galaxy-0.1.9.dist-info/LICENSE sha256=hIahDEOTzuHCU5J2nd07LWwkLW7Hko4UFO__ffsvB-8 34523
dflow_galaxy-0.1.9.dist-info/METADATA sha256=Z0H7UKRWRUcRLieGKoo1AaZGDF8L12TcjNbcgusHUWc 2694
dflow_galaxy-0.1.9.dist-info/WHEEL sha256=FMvqSimYX_P7y0a7UY-_Mc83r5zkBZsCYPm7Lr0Bsq4 88
dflow_galaxy-0.1.9.dist-info/entry_points.txt sha256=b7q2kBL3HM4nXx_kRvXjD-DS8D5N9wAVgaadsVLkGG8 48
dflow_galaxy-0.1.9.dist-info/RECORD — —

entry_points.txt

[console_scripts]
dgcli = dflow_galaxy.main:main