cjs14
by Chris Sewell
by Chris Sewell
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| Name | Latest Version | Summary | Updated | License |
|---|
| nose-parameterized | 0.3.5 | Decorator for parameterized testing with Nose | Mar 25, 2025 | BSD License |
| python-docx | 0.8.5 | Create and update Microsoft Word .docx files. | Mar 25, 2025 | MIT License |
| cclib | 1.3 | cclib: parsers and algorithms for computational chemistry | Mar 25, 2025 | GNU Library or Lesser General Public License (LGPL) |
| chemview | 0.3 | WebGL Molecular Viewer for IPython notebook. | Mar 25, 2025 | GNU Lesser General Public License v2 or later (LGPLv2+) |
| pygauss | 0.6.0 | Python API for Analysis of Gaussian Quantum Chemical Compuations | Mar 25, 2025 | GNU General Public License v3 (GPLv3) |
| pyopengl | 3.0.2 | — | Mar 25, 2025 | BSD |
| chemlab | 0.4 | The Python Computational Chemistry library you were waiting for. | Mar 25, 2025 | GNU General Public License v3 (GPLv3) |
| pgtest | 1.3.1 | Creates a temporary, local PostgreSQL database cluster and server for unittesting, and cleans up after itself | Mar 25, 2025 | MIT |
| sqlalchemy-diff | 0.1.3 | Compare two database schemas using sqlalchemy. | Mar 25, 2025 | Apache, Version 2.0 |
| coveralls | 0.5 | Show coverage stats online via coveralls.io | Mar 25, 2025 | MIT License |
| activate-aiida | 0.3.0 | a package to activate an aiida environment, from a yaml config file | Mar 25, 2025 | MIT |
| ipymd | 0.4.2 | — | Mar 25, 2025 | — |
| apscheduler | 2.1.2 | In-process task scheduler with Cron-like capabilities | Mar 25, 2025 | MIT |
| pg8000 | 1.12.5 | PostgreSQL interface library | Mar 25, 2025 | BSD |
| aiida_conda_scheduler | 0.1.0 | AiiDA scheduler plugins that allow for `conda run`. | Mar 25, 2025 | MIT |
| aiida-gaussian-datatypes | 0.5.1 | AiiDA data plugin to manage gaussian datatypes (basis sets and pseudopotentials) as first-class citizens | Mar 25, 2025 | MIT |
| aiida-cp2k | 1.5.0 | The official AiiDA plugin for CP2K. | Mar 25, 2025 | MIT |
| nose-cov | 1.6 | nose plugin for coverage reporting, including subprocesses and multiprocessing | Mar 25, 2025 | MIT License |
| prospector.add_ons | 1.2.0 | Prospector: python static analysis tool | Mar 25, 2025 | GNU General Public v2 or later (GPLv2+) |
| aiida-icl | 0.3.4 | AiiDA plugin interfacing with the Imperial College London cx1 HPC | Mar 25, 2025 | MIT |
| nose2 | 0.4.7 | nose2 is the next generation of nicer testing for Python | Mar 25, 2025 | BSD License |
| qe-tools | 1.1.3 | A set of useful tools to manage Quantum ESPRESSO files | Mar 25, 2025 | MIT |
| prospector | 1.2.0 | Prospector: python static analysis tool | Mar 25, 2025 | GNU General Public v2 or later (GPLv2+) |
| seekpath | 1.9.3 | A module to obtain and visualize k-vector coefficients and obtain band paths in the Brillouin zone of crystal structures | Mar 25, 2025 | MIT |
| aiida-quantumespresso | 2.1.1a2 | The official AiiDA plugin for Quantum ESPRESSO | Mar 25, 2025 | MIT |