{"id":15010026,"url":"https://github.com/nlesc-nano/nano-cat","last_synced_at":"2025-04-09T17:53:23.443Z","repository":{"id":35008145,"uuid":"194105800","full_name":"nlesc-nano/nano-CAT","owner":"nlesc-nano","description":"A collection of tools for the analysis of nanocrystals.","archived":false,"fork":false,"pushed_at":"2024-02-05T14:09:26.000Z","size":1215,"stargazers_count":4,"open_issues_count":7,"forks_count":2,"subscribers_count":1,"default_branch":"master","last_synced_at":"2025-03-23T19:51:34.165Z","etag":null,"topics":["automation","chemistry","python-3-6","python-3-7","science","scientific-workflow","workflow"],"latest_commit_sha":null,"homepage":null,"language":"Python","has_issues":true,"has_wiki":null,"has_pages":null,"mirror_url":null,"source_name":null,"license":"other","status":null,"scm":"git","pull_requests_enabled":true,"icon_url":"https://github.com/nlesc-nano.png","metadata":{"files":{"readme":"README.rst","changelog":"CHANGELOG.rst","contributing":"CONTRIBUTING.rst","funding":null,"license":"LICENSE.md","code_of_conduct":"CODE_OF_CONDUCT.rst","threat_model":null,"audit":null,"citation":"CITATION.cff","codeowners":null,"security":null,"support":null,"governance":null,"roadmap":null,"authors":null,"dei":null,"publiccode":null,"codemeta":null}},"created_at":"2019-06-27T14:00:37.000Z","updated_at":"2025-01-28T15:24:28.000Z","dependencies_parsed_at":"2024-01-16T10:37:30.783Z","dependency_job_id":"251da43d-d401-4029-a188-1c54d9cd2418","html_url":"https://github.com/nlesc-nano/nano-CAT","commit_stats":{"total_commits":457,"total_committers":5,"mean_commits":91.4,"dds":"0.24070021881838077","last_synced_commit":"53f8b85f9ab10236aeeeb5ab503c6047f9ad4b1f"},"previous_names":[],"tags_count":3,"template":false,"template_full_name":null,"repository_url":"https://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories/nlesc-nano%2Fnano-CAT","tags_url":"https://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories/nlesc-nano%2Fnano-CAT/tags","releases_url":"https://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories/nlesc-nano%2Fnano-CAT/releases","manifests_url":"https://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories/nlesc-nano%2Fnano-CAT/manifests","owner_url":"https://repos.ecosyste.ms/api/v1/hosts/GitHub/owners/nlesc-nano","download_url":"https://codeload.github.com/nlesc-nano/nano-CAT/tar.gz/refs/heads/master","host":{"name":"GitHub","url":"https://github.com","kind":"github","repositories_count":248083479,"owners_count":21045105,"icon_url":"https://github.com/github.png","version":null,"created_at":"2022-05-30T11:31:42.601Z","updated_at":"2022-07-04T15:15:14.044Z","host_url":"https://repos.ecosyste.ms/api/v1/hosts/GitHub","repositories_url":"https://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories","repository_names_url":"https://repos.ecosyste.ms/api/v1/hosts/GitHub/repository_names","owners_url":"https://repos.ecosyste.ms/api/v1/hosts/GitHub/owners"}},"keywords":["automation","chemistry","python-3-6","python-3-7","science","scientific-workflow","workflow"],"created_at":"2024-09-24T19:29:34.817Z","updated_at":"2025-04-09T17:53:23.406Z","avatar_url":"https://github.com/nlesc-nano.png","language":"Python","funding_links":[],"categories":[],"sub_categories":[],"readme":".. image:: https://github.com/nlesc-nano/nano-CAT/workflows/Build%20with%20Conda/badge.svg\n   :target: https://github.com/nlesc-nano/nano-CAT/actions?query=workflow%3A%22Build+with+Conda%22\n.. image:: https://readthedocs.org/projects/cat/badge/?version=latest\n   :target: https://cat.readthedocs.io/en/latest/\n.. image:: https://badge.fury.io/py/nano-CAT.svg\n   :target: https://badge.fury.io/py/nano-CAT\n\n|\n\n.. image:: https://img.shields.io/badge/python-3.7-blue.svg\n   :target: https://docs.python.org/3.7/\n.. image:: https://img.shields.io/badge/python-3.8-blue.svg\n   :target: https://docs.python.org/3.8/\n.. image:: https://img.shields.io/badge/python-3.9-blue.svg\n   :target: https://docs.python.org/3.9/\n.. image:: https://img.shields.io/badge/python-3.10-blue.svg\n   :target: https://docs.python.org/3.10/\n.. image:: https://img.shields.io/badge/python-3.10-blue.svg\n   :target: https://docs.python.org/3.11/\n\n########\nNano-CAT\n########\n\n**Nano-CAT** is a collection of tools for the analysis of nanocrystals,\nbuilding on the framework of the Compound Attachment Tools package (CAT_).\n\n\nInstallation\n============\n\n- Download miniconda for python3: miniconda_ (also you can install the complete anaconda_ version).\n\n- Install according to: installConda_.\n\n- Create a new virtual environment, for python 3.7, using the following commands:\n\n  - ``conda create --name CAT python``\n\n- The virtual environment can be enabled and disabled by, respectively, typing:\n\n  - Enable: ``conda activate CAT``\n\n  - Disable: ``conda deactivate``\n\n\nDependencies installation\n-------------------------\n\nUsing the conda environment the following packages should be installed:\n\n- rdkit_: ``conda install -y --name CAT --channel conda-forge rdkit``\n\n\nPackage installation\n--------------------\nFinally, install **Nano-CAT** using pip:\n\n- **Nano-CAT**: ``pip install nano-CAT --upgrade``\n\nNow you are ready to use **Nano-CAT**.\n\n\n.. _miniconda: http://conda.pydata.org/miniconda.html\n.. _anaconda: https://www.continuum.io/downloads\n.. _installConda: https://docs.anaconda.com/anaconda/install/\n.. _CAT: https://github.com/nlesc-nano/CAT\n.. _rdkit: http://www.rdkit.org\n","project_url":"https://awesome.ecosyste.ms/api/v1/projects/github.com%2Fnlesc-nano%2Fnano-cat","html_url":"https://awesome.ecosyste.ms/projects/github.com%2Fnlesc-nano%2Fnano-cat","lists_url":"https://awesome.ecosyste.ms/api/v1/projects/github.com%2Fnlesc-nano%2Fnano-cat/lists"}