Ecosyste.ms: Packages

An open API service providing package, version and dependency metadata of many open source software ecosystems and registries.

pypi.org "computational-science" keyword

Top 2.2% on pypi.org
aiida-core 2.5.1
AiiDA is a workflow manager for computational science with a strong focus on provenance, performa...
81 versions - Latest release: 4 months ago - 38 dependent packages - 45 dependent repositories - 9.52 thousand downloads last month - 388 stars on GitHub - 7 maintainers
Top 2.0% on pypi.org
pytensor 2.21.0 💰
Optimizing compiler for evaluating mathematical expressions on CPUs and GPUs.
40 versions - Latest release: 3 days ago - 25 dependent packages - 46 dependent repositories - 193 thousand downloads last month - 240 stars on GitHub - 3 maintainers
Top 6.2% on pypi.org
stk 2024.3.28.0 💰
A Python library which allows construction and manipulation of complex molecules, as well as auto...
114 versions - Latest release: about 2 months ago - 8 dependent packages - 5 dependent repositories - 676 downloads last month - 237 stars on GitHub - 2 maintainers
Top 6.9% on pypi.org
sciris 3.1.6
Fast, flexible tools to simplify scientific Python
64 versions - Latest release: about 2 months ago - 8 dependent packages - 18 dependent repositories - 2.32 thousand downloads last month - 29 stars on GitHub - 3 maintainers
gracc 0.1.1
Solving Electrical Circuit using graph
3 versions - Latest release: over 1 year ago - 7 downloads last month - 3 stars on GitHub - 1 maintainer
sshcustodian 0.2.6
A modification to the Custodian class in custodian (github.com/materialsproject/custodian) to all...
9 versions - Latest release: almost 8 years ago - 1 dependent repositories - 73 downloads last month - 0 stars on GitHub - 1 maintainer
Top 7.3% on pypi.org
reprozip 1.0.16
Linux tool enabling reproducible experiments (packer)
35 versions - Latest release: over 5 years ago - 7 dependent repositories - 659 downloads last month - 295 stars on GitHub - 2 maintainers
reprozip-jupyter 1.0.14
Jupyter Notebook tracing/reproduction using ReproZip
8 versions - Latest release: almost 6 years ago - 1 dependent repositories - 104 downloads last month - 295 stars on GitHub - 2 maintainers
reprounzip-vistrails 1.0.16
Integrates the ReproZip unpacker with the VisTrails workflow management system
12 versions - Latest release: over 5 years ago - 1 dependent package - 4 dependent repositories - 145 downloads last month - 295 stars on GitHub - 2 maintainers
Top 9.7% on pypi.org
reprounzip-vagrant 1.0.13
Allows the ReproZip unpacker to create virtual machines
25 versions - Latest release: about 6 years ago - 1 dependent package - 4 dependent repositories - 247 downloads last month - 295 stars on GitHub - 2 maintainers
Top 8.7% on pypi.org
reprounzip-docker 1.0.16
Allows the ReproZip unpacker to create Docker containers
25 versions - Latest release: over 5 years ago - 1 dependent package - 7 dependent repositories - 221 downloads last month - 295 stars on GitHub - 2 maintainers
reprounzip-qt 1.2.1
Graphical user interface for reprounzip, using Qt
12 versions - Latest release: over 1 year ago - 1 dependent repositories - 153 downloads last month - 295 stars on GitHub - 2 maintainers
Top 6.5% on pypi.org
reprounzip 1.2.1
Linux tool enabling reproducible experiments (unpacker)
32 versions - Latest release: over 1 year ago - 5 dependent packages - 10 dependent repositories - 380 downloads last month - 295 stars on GitHub - 2 maintainers
prospr 1.2.1
A toolbox for protein folding with Python.
59 versions - Latest release: 4 months ago - 1 dependent repositories - 1.5 thousand downloads last month - 18 stars on GitHub - 1 maintainer
neighbormodels 0.2.2
A tool for building crystal lattice models with distance-dependent neighbor interactions.
4 versions - Latest release: almost 5 years ago - 1 dependent repositories - 33 downloads last month - 2 stars on GitHub - 1 maintainer
turing-machine-utils 1.0.7 💰
Calculate the result of a turing machine on a given tape
8 versions - Latest release: 5 months ago - 62 downloads last month - 0 stars on GitHub - 1 maintainer
aiida-core-bot 1.0.0b5
The official repository for the AiiDA code
5 versions - Latest release: about 5 years ago - 41 downloads last month - 400 stars on GitHub - 1 maintainer
Related Keywords
python 12 provenance 9 scientific-computing 8 reprozip 7 reprounzip 7 reproducibility 7 vida 7 nyu 7 archiving 7 docker 7 hacktoberfest 7 linux 7 ptrace 7 reproducible-research 7 reproducible-science 7 science 7 vagrant 7 materials-science 3 workflow-engine 2 workflow 2 ssh 2 scheduler 2 database 2 data-provenance 2 numpy 2 workflows 2 aiida 2 lattice 1 magnetism 1 neighbor-count 1 neighbors 1 Turing Machine 1 Turing Machine Simulator 1 Python 1 Automata 1 Simulation 1 Computational Theory 1 State Machine 1 Algorithm 1 ising-model 1 heisenberg-model 1 condensed-matter-physics 1 structure-prediction 1 protein-structure-prediction 1 protein-folding 1 high-performance-computing 1 datasets 1 cpp 1 bioinformatics 1 package 1 pypi 1 Computer Engineering 1 Software Development 1 algorithm 1 artificial-intelligence 1 automata 1 complexity 1 computational-theory 1 education 1 machine-learning 1 open-source 1 python3 1 simulation 1 state-machine 1 turing-machine 1 turing-machine-simulator 1 universal-turing-machine 1 Artificial Intelligence 1 Machine Learning 1 Computational Science 1 Programming 1 Open Source 1 Education 1 Computer Science 1 Formal Languages 1 Computational Models 1 Tape 1 States 1 Transition Rules 1 Simulation Tool 1 Complexity 1 Symbol 1 Universal Turing Machine 1 Solver 1 Circuit 1 Electrical 1 utilities 1 autodiff 1 differentiation 1 plotting 1 parallelization 1 matplotlib 1 data-science 1 containers 1 framework 1 webapp 1 scientific 1 reactions 1 molecular-structures 1 molecular-modeling 1