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pypi.org : pyscf
PySCF: Python-based Simulations of Chemistry Framework
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purl: pkg:pypi/pyscf
License: Apache-2.0
Latest release: 3 days ago
First release: over 7 years ago
Dependent packages: 42
Dependent repositories: 192
Downloads: 89,881 last month
Stars: 1,275 on GitHub
Forks: 591 on GitHub
Docker dependents: 4
Docker downloads: 889
Total Commits: 7415
Committers: 168
Average commits per author: 44.137
Development Distribution Score (DDS): 0.429
More commit stats: commits.ecosyste.ms
See more repository details: repos.ecosyste.ms
Funding links: https://github.com/sponsors/sunqm
Last synced: 3 days ago
tangelo-gc 0.4.3
Tangelo is an open-source Python package maintained by Good Chemistry Company, focusing on the de...10 versions - Latest release: 10 months ago - 385 downloads last month - 121 stars on GitHub - 2 maintainers
benchq 0.7.0
"BenchQ platform for resource estimation"4 versions - Latest release: about 1 year ago - 78 downloads last month - 41 stars on GitHub - 2 maintainers
qiskit-qulacs 0.1.0
Qiskit Qulacs to execute Qiskit programs using Qulacs as backend.2 versions - Latest release: about 1 year ago - 277 downloads last month - 10 stars on GitHub - 1 maintainer
quri-parts-pyscf 17.0.0
A plugin to use PySCF with QURI Parts26 versions - Latest release: about 1 year ago - 1 dependent package - 1 dependent repositories - 916 downloads last month - 44 stars on GitHub - 1 maintainer
cclib 1.8.1
parsers and algorithms for computational chemistry37 versions - Latest release: about 1 year ago - 20 dependent packages - 41 dependent repositories - 14.1 thousand downloads last month - 357 stars on GitHub - 5 maintainers
amcess2024 0.1.2
Atomic and Molecular Cluster Energy Surface Sampler3 versions - Latest release: about 1 year ago - 80 downloads last month - 2 stars on gitlab.com - 2 maintainers
vqepy 1.0.1
An open source Python package for molecular and condensed matter VQE research3 versions - Latest release: about 1 year ago - 141 downloads last month - 1 stars on GitHub - 1 maintainer
pyxdh 0.0.7
Document and code of python and PySCF approach XYG3 type of density functional realization6 versions - Latest release: about 1 year ago - 1 dependent repositories - 235 downloads last month - 57 stars on GitHub - 1 maintainer
qiskit-nature-pyscf 0.4.0
Qiskit Nature PySCF: Third-party integration plugin of Qiskit Nature + PySCF.5 versions - Latest release: about 1 year ago - 1 dependent repositories - 410 downloads last month - 19 stars on GitHub - 1 maintainer
qiskit-nature 0.7.2
Qiskit Nature: A library of quantum computing chemistry/physics experiments27 versions - Latest release: about 1 year ago - 10 dependent packages - 31 dependent repositories - 19.2 thousand downloads last month - 326 stars on GitHub - 1 maintainer
torchquantum 0.1.8
Quantum Computing in PyTorch9 versions - Latest release: about 1 year ago - 1 dependent package - 1 dependent repositories - 1.17 thousand downloads last month - 1,434 stars on GitHub - 1 maintainer
hmpol 0.1.5
A package to calculate the moments and polarizabilities of molecules6 versions - Latest release: about 1 year ago - 262 downloads last month - 1 stars on gitlab.com - 1 maintainer
qmctorch 0.3.2
Pytorch Implementation of Quantum Monte Carlo6 versions - Latest release: over 1 year ago - 1 dependent repositories - 281 downloads last month - 26 stars on GitHub - 1 maintainer
jaqalpaq 1.2.0
Python tools for Jaqal11 versions - Latest release: over 1 year ago - 1 dependent package - 1 dependent repositories - 694 downloads last month - 3 stars on gitlab.com - 3 maintainers
qmlearn 0.0.1
QMLearn3 versions - Latest release: over 1 year ago - 119 downloads last month - 12 stars on gitlab.com - 1 maintainer
pyqmc 0.6.0
Python library for real space quantum Monte Carlo11 versions - Latest release: almost 2 years ago - 1 dependent package - 1 dependent repositories - 1.22 thousand downloads last month - 81 stars on GitHub - 1 maintainer
paddle-quantum 2.4.0
Paddle Quantum is a quantum machine learning (QML) toolkit developed based on Baidu PaddlePaddle.13 versions - Latest release: about 2 years ago - 1 dependent repositories - 508 downloads last month - 557 stars on GitHub - 1 maintainer
dive-into-graphs 1.1.0
DIG: Dive into Graphs is a turnkey library for graph deep learning research.10 versions - Latest release: about 2 years ago - 8 dependent repositories - 910 downloads last month - 1,949 stars on GitHub - 1 maintainer
jaqalpaq-dev 1.1.0b1
Python tools for Jaqal1 version - Latest release: about 2 years ago - 65 downloads last month - 3 stars on gitlab.com - 3 maintainers
pysisyphus 0.7.6
Python suite for exploring potential energy surfaces.42 versions - Latest release: almost 3 years ago - 1 dependent repositories - 1.13 thousand downloads last month - 109 stars on GitHub - 1 maintainer
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