diff --git a/README.md b/README.md index cd19769..5513046 100644 --- a/README.md +++ b/README.md @@ -51,31 +51,31 @@ This curated list contains 38 awesome open-source projects with a total of 3.7K ``` git clone https://github.com/deepmodeling/deepmd-kit ``` -- [PyPi](https://pypi.org/project/deepmd-kit) (📥 4.8K / month): +- [PyPi](https://pypi.org/project/deepmd-kit) (📥 6K / month): ``` pip install deepmd-kit ``` -- [Conda](https://anaconda.org/conda-forge/deepmd-kit) (📥 1.3M · ⏱️ 24.12.2024): +- [Conda](https://anaconda.org/conda-forge/deepmd-kit) (📥 1.4M · ⏱️ 24.12.2024): ``` conda install -c conda-forge deepmd-kit ``` -- [npm](https://www.npmjs.com/package/deepmd-kit) (📥 31 / month): +- [npm](https://www.npmjs.com/package/deepmd-kit) (📥 15 / month): ``` npm install deepmd-kit ``` -- [Docker Hub](https://hub.docker.com/r/deepmodeling/deepmd-kit) (📥 3.2K · ⭐ 1 · ⏱️ 25.11.2024): +- [Docker Hub](https://hub.docker.com/r/deepmodeling/deepmd-kit) (📥 3.3K · ⭐ 1 · ⏱️ 25.11.2024): ``` docker pull deepmodeling/deepmd-kit ```
ABACUS (🥇26 · ⭐ 180) - An electronic structure package based on either plane wave basis or numerical atomic orbitals. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/abacus-develop) (👨‍💻 120 · 🔀 140 · 📋 2.1K - 6% open · ⏱️ 26.12.2024): +- [GitHub](https://github.com/deepmodeling/abacus-develop) (👨‍💻 120 · 🔀 140 · 📋 2.1K - 6% open · ⏱️ 02.01.2025): ``` git clone https://github.com/deepmodeling/abacus-develop ``` -- [Conda](https://anaconda.org/conda-forge/abacus) (📥 260K · ⏱️ 14.12.2024): +- [Conda](https://anaconda.org/conda-forge/abacus) (📥 270K · ⏱️ 27.12.2024): ``` conda install -c conda-forge abacus ``` @@ -87,7 +87,7 @@ This curated list contains 38 awesome open-source projects with a total of 3.7K ``` git clone https://github.com/deepmodeling/dpgen ``` -- [PyPi](https://pypi.org/project/dpgen) (📥 730 / month): +- [PyPi](https://pypi.org/project/dpgen) (📥 870 / month): ``` pip install dpgen ``` @@ -103,11 +103,11 @@ This curated list contains 38 awesome open-source projects with a total of 3.7K ``` git clone https://github.com/deepmodeling/dpdata ``` -- [PyPi](https://pypi.org/project/dpdata) (📥 26K / month): +- [PyPi](https://pypi.org/project/dpdata) (📥 21K / month): ``` pip install dpdata ``` -- [Conda](https://anaconda.org/conda-forge/dpdata) (📥 85K · ⏱️ 21.09.2024): +- [Conda](https://anaconda.org/conda-forge/dpdata) (📥 85K · ⏱️ 27.12.2024): ``` conda install -c conda-forge dpdata ``` @@ -116,18 +116,18 @@ This curated list contains 38 awesome open-source projects with a total of 3.7K docker pull dptechnology/dpdata ```
-
dpdispatcher (🥈22 · ⭐ 46) - generate HPC scheduler systems jobs input scripts and submit these scripts to HPC systems and poke until they finish. LGPL-3.0 +
dpdispatcher (🥈22 · ⭐ 47) - generate HPC scheduler systems jobs input scripts and submit these scripts to HPC systems and poke until they finish. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/dpdispatcher) (👨‍💻 46 · 🔀 54 · 📦 53 · 📋 81 - 22% open · ⏱️ 23.12.2024): ``` git clone https://github.com/deepmodeling/dpdispatcher ``` -- [PyPi](https://pypi.org/project/dpdispatcher) (📥 2.8K / month): +- [PyPi](https://pypi.org/project/dpdispatcher) (📥 3.2K / month): ``` pip install dpdispatcher ``` -- [Conda](https://anaconda.org/conda-forge/dpdispatcher) (📥 18K · ⏱️ 31.08.2024): +- [Conda](https://anaconda.org/conda-forge/dpdispatcher) (📥 19K · ⏱️ 30.12.2024): ``` conda install -c conda-forge dpdispatcher ``` @@ -143,27 +143,27 @@ This curated list contains 38 awesome open-source projects with a total of 3.7K ``` git clone https://github.com/deepmodeling/reacnetgenerator ``` -- [PyPi](https://pypi.org/project/reacnetgenerator) (📥 3.7K / month): +- [PyPi](https://pypi.org/project/reacnetgenerator) (📥 3.8K / month): ``` pip install reacnetgenerator ``` -- [Conda](https://anaconda.org/conda-forge/reacnetgenerator) (📥 470K · ⏱️ 04.10.2024): +- [Conda](https://anaconda.org/conda-forge/reacnetgenerator) (📥 480K · ⏱️ 04.10.2024): ``` conda install -c conda-forge reacnetgenerator ```
-
dargs (🥈19 · ⭐ 5 · 📉) - Argument processing for the deep modeling project. LGPL-3.0 +
dargs (🥈19 · ⭐ 5) - Argument processing for the deep modeling project. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/dargs) (👨‍💻 7 · 🔀 3 · 📦 130 · 📋 9 - 22% open · ⏱️ 27.11.2024): ``` git clone https://github.com/deepmodeling/dargs ``` -- [PyPi](https://pypi.org/project/dargs) (📥 58K / month): +- [PyPi](https://pypi.org/project/dargs) (📥 44K / month): ``` pip install dargs ``` -- [Conda](https://anaconda.org/conda-forge/dargs) (📥 36K · ⏱️ 22.12.2024): +- [Conda](https://anaconda.org/conda-forge/dargs) (📥 37K · ⏱️ 22.12.2024): ``` conda install -c conda-forge dargs ``` @@ -188,18 +188,18 @@ This curated list contains 38 awesome open-source projects with a total of 3.7K docker pull dptechnology/dflow ```
-
DPGEN2 (🥈17 · ⭐ 33) - 2nd generation of the Deep Potential GENerator. LGPL-3.0 +
DPGEN2 (🥈16 · ⭐ 33 · 📉) - 2nd generation of the Deep Potential GENerator. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/dpgen2) (👨‍💻 14 · 🔀 26 · 📦 5 · 📋 34 - 32% open · ⏱️ 03.12.2024): ``` git clone https://github.com/deepmodeling/dpgen2 ``` -- [PyPi](https://pypi.org/project/dpgen2) (📥 190 / month): +- [PyPi](https://pypi.org/project/dpgen2) (📥 260 / month): ``` pip install dpgen2 ``` -- [Docker Hub](https://hub.docker.com/r/dptechnology/dpgen2) (📥 3.7K · ⏱️ 03.12.2024): +- [Docker Hub](https://hub.docker.com/r/dptechnology/dpgen2) (📥 3.8K · ⏱️ 03.12.2024): ``` docker pull dptechnology/dpgen2 ``` @@ -214,41 +214,53 @@ This curated list contains 38 awesome open-source projects with a total of 3.7K
DeePTB (🥈15 · ⭐ 59) - DeePTB: A deep learning package for tight-binding approach with ab initio accuracy. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/DeePTB) (👨‍💻 10 · 🔀 16 · 📦 2 · 📋 38 - 23% open · ⏱️ 24.12.2024): +- [GitHub](https://github.com/deepmodeling/DeePTB) (👨‍💻 10 · 🔀 16 · 📦 2 · 📋 38 - 23% open · ⏱️ 01.01.2025): ``` git clone https://github.com/deepmodeling/DeePTB ``` -- [PyPi](https://pypi.org/project/dptb) (📥 200 / month): +- [PyPi](https://pypi.org/project/dptb) (📥 240 / month): ``` pip install dptb ```
+
APEX (🥈15 · ⭐ 26 · 📈) - APEX: Alloy Properties EXplorer using simulations. LGPL-3.0 + +- [GitHub](https://github.com/deepmodeling/APEX) (👨‍💻 6 · 🔀 18 · 📦 3 · 📋 9 - 11% open · ⏱️ 25.10.2024): + + ``` + git clone https://github.com/deepmodeling/APEX + ``` +- [PyPi](https://pypi.org/project/apex-flow) (📥 1.2K / month): + ``` + pip install apex-flow + ``` +
DP-GUI (🥈15 · ⭐ 7) - A web-based GUI for user inputs. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dpgui) (👨‍💻 4 · 🔀 5 · 📦 9 · ⏱️ 26.11.2024): +- [GitHub](https://github.com/deepmodeling/dpgui) (👨‍💻 4 · 🔀 5 · 📦 9 · ⏱️ 30.12.2024): ``` git clone https://github.com/deepmodeling/dpgui ``` -- [PyPi](https://pypi.org/project/dpgui) (📥 22K / month): +- [PyPi](https://pypi.org/project/dpgui) (📥 16K / month): ``` pip install dpgui ```
-
JAX-FEM (🥈14 · ⭐ 320 · 📉) - Differentiable Finite Element Method with JAX. GPL-3.0 +
JAX-FEM (🥈14 · ⭐ 320) - Differentiable Finite Element Method with JAX. GPL-3.0 - [GitHub](https://github.com/deepmodeling/jax-fem) (👨‍💻 9 · 🔀 46 · 📦 3 · 📋 41 - 60% open · ⏱️ 13.12.2024): ``` git clone https://github.com/deepmodeling/jax-fem ``` -- [PyPi](https://pypi.org/project/jax-fem) (📥 270 / month): +- [PyPi](https://pypi.org/project/jax-fem) (📥 330 / month): ``` pip install jax-fem ```
-
DMFF (🥈14 · ⭐ 160 · 💤) - DMFF (Differentiable Molecular Force Field) is a Jax-based python package that provides a full differentiable.. LGPL-3.0 +
DMFF (🥈13 · ⭐ 160 · 💤) - DMFF (Differentiable Molecular Force Field) is a Jax-based python package that provides a full differentiable.. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/DMFF) (👨‍💻 14 · 🔀 45 · 📋 27 - 40% open · ⏱️ 12.01.2024): @@ -260,45 +272,33 @@ This curated list contains 38 awesome open-source projects with a total of 3.7K conda install -c conda-forge dmff ```
-
APEX (🥈14 · ⭐ 25 · 📉) - APEX: Alloy Properties EXplorer using simulations. LGPL-3.0 - -- [GitHub](https://github.com/deepmodeling/APEX) (👨‍💻 6 · 🔀 18 · 📦 3 · 📋 9 - 11% open · ⏱️ 25.10.2024): - - ``` - git clone https://github.com/deepmodeling/APEX - ``` -- [PyPi](https://pypi.org/project/apex-flow) (📥 1K / month): - ``` - pip install apex-flow - ``` -
-
rid-kit (🥉13 · ⭐ 46) - Reinforced dynamics. LGPL-3.0 +
rid-kit (🥈13 · ⭐ 46 · 💤) - Reinforced dynamics. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/rid-kit) (👨‍💻 14 · 🔀 23 · 📥 150 · 📦 2 · 📋 5 - 40% open · ⏱️ 27.06.2024): ``` git clone https://github.com/deepmodeling/rid-kit ``` -- [PyPi](https://pypi.org/project/rid-kit) (📥 190 / month): +- [PyPi](https://pypi.org/project/rid-kit) (📥 260 / month): ``` pip install rid-kit ```
-
deepmodeling_sphinx (🥉13 · ⭐ 3) - Sphinx extension for DeepModeling projects. LGPL-3.0 +
deepmodeling_sphinx (🥈13 · ⭐ 3) - Sphinx extension for DeepModeling projects. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/deepmodeling_sphinx) (👨‍💻 7 · 🔀 7 · ⏱️ 27.10.2024): ``` git clone https://github.com/deepmodeling/deepmodeling_sphinx ``` -- [PyPi](https://pypi.org/project/deepmodeling_sphinx) (📥 2.5K / month): +- [PyPi](https://pypi.org/project/deepmodeling_sphinx) (📥 2.3K / month): ``` pip install deepmodeling_sphinx ```
-
GPUMD (🥉12 · ⭐ 4 · 🐣) - Graphics Processing Units Molecular Dynamics. GPL-3.0 +
GPUMD (🥉12 · ⭐ 4) - Graphics Processing Units Molecular Dynamics. GPL-3.0 -- [GitHub](https://github.com/deepmodeling/GPUMD) (👨‍💻 39 · ⏱️ 01.12.2024): +- [GitHub](https://github.com/deepmodeling/GPUMD) (👨‍💻 41 · ⏱️ 26.12.2024): ``` git clone https://github.com/deepmodeling/GPUMD @@ -306,47 +306,47 @@ This curated list contains 38 awesome open-source projects with a total of 3.7K
args (🥉11 · ⭐ 2) - DeepModeling dargs arguments generation. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/args) (👨‍💻 3 · 🔀 2 · 📦 5 · ⏱️ 12.12.2024): +- [GitHub](https://github.com/deepmodeling/args) (👨‍💻 3 · 🔀 2 · 📦 5 · ⏱️ 30.12.2024): ``` git clone https://github.com/deepmodeling/args ``` -- [npm](https://www.npmjs.com/package/@deepmodeling/args) (📥 220 / month): +- [npm](https://www.npmjs.com/package/@deepmodeling/args) (📥 240 / month): ``` npm install @deepmodeling/args ```
-
DeePKS-kit (🥉9 · ⭐ 100 · 💤) - a package for developing machine learning-based chemically accurate energy and density functional models. LGPL-3.0 +
dpti (🥉10 · ⭐ 22 · 📈) - A Python Package to Automate Thermodynamic Integration Calculations for Free Energy. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/deepks-kit) (👨‍💻 7 · 🔀 36 · 📋 24 - 41% open · ⏱️ 13.04.2024): +- [GitHub](https://github.com/deepmodeling/dpti) (👨‍💻 18 · 🔀 19 · 📦 2 · 📋 10 - 90% open · ⏱️ 30.12.2024): ``` - git clone https://github.com/deepmodeling/deepks-kit + git clone https://github.com/deepmodeling/dpti + ``` +- [PyPi](https://pypi.org/project/dpti) (📥 95 / month): + ``` + pip install dpti ```
-
dpti (🥉9 · ⭐ 22) - A Python Package to Automate Thermodynamic Integration Calculations for Free Energy. LGPL-3.0 +
DeePKS-kit (🥉9 · ⭐ 100 · 💤) - a package for developing machine learning-based chemically accurate energy and density functional models. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dpti) (👨‍💻 18 · 🔀 19 · 📦 2 · 📋 10 - 90% open · ⏱️ 20.11.2024): +- [GitHub](https://github.com/deepmodeling/deepks-kit) (👨‍💻 7 · 🔀 36 · 📋 24 - 41% open · ⏱️ 13.04.2024): ``` - git clone https://github.com/deepmodeling/dpti - ``` -- [PyPi](https://pypi.org/project/dpti) (📥 77 / month): - ``` - pip install dpti + git clone https://github.com/deepmodeling/deepks-kit ```
Blog (🥉9 · ⭐ 1) - DeepModeling Blog. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/blog) (👨‍💻 9 · 🔀 8 · ⏱️ 26.12.2024): +- [GitHub](https://github.com/deepmodeling/blog) (👨‍💻 9 · 🔀 8 · ⏱️ 02.01.2025): ``` git clone https://github.com/deepmodeling/blog ```
-
AIS-Square (🥉8 · ⭐ 12) - LGPL-3.0 +
AIS-Square (🥉8 · ⭐ 13) - LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/AIS-Square) (👨‍💻 8 · 🔀 8 · 📋 6 - 83% open · ⏱️ 25.12.2024): +- [GitHub](https://github.com/deepmodeling/AIS-Square) (👨‍💻 8 · 🔀 8 · 📋 6 - 83% open · ⏱️ 28.12.2024): ``` git clone https://github.com/deepmodeling/AIS-Square @@ -367,7 +367,7 @@ This curated list contains 38 awesome open-source projects with a total of 3.7K ``` git clone https://github.com/deepmodeling/fealpy ``` -- [PyPi](https://pypi.org/project/fealpy) (📥 330 / month): +- [PyPi](https://pypi.org/project/fealpy) (📥 650 / month): ``` pip install fealpy ``` @@ -379,7 +379,7 @@ This curated list contains 38 awesome open-source projects with a total of 3.7K ``` git clone https://github.com/deepmodeling/fpop ``` -- [PyPi](https://pypi.org/project/fpop) (📥 450 / month): +- [PyPi](https://pypi.org/project/fpop) (📥 560 / month): ``` pip install fpop ``` @@ -391,7 +391,7 @@ This curated list contains 38 awesome open-source projects with a total of 3.7K ``` git clone https://github.com/deepmodeling/Uni-Fold ``` -- [Docker Hub](https://hub.docker.com/r/dptechnology/unifold) (📥 790 · ⏱️ 08.01.2024): +- [Docker Hub](https://hub.docker.com/r/dptechnology/unifold) (📥 810 · ⏱️ 08.01.2024): ``` docker pull dptechnology/unifold ``` @@ -412,14 +412,6 @@ This curated list contains 38 awesome open-source projects with a total of 3.7K git clone https://github.com/deepmodeling/tbplas ```
-
docs (🥉6 · ⭐ 3) - The home page of DeepModeling documentation. LGPL-3.0 - -- [GitHub](https://github.com/deepmodeling/docs) (👨‍💻 8 · 🔀 7 · ⏱️ 28.10.2024): - - ``` - git clone https://github.com/deepmodeling/docs - ``` -
AI4Science101 (🥉5 · ⭐ 86 · 💤) - AI for Science. Unlicensed - [GitHub](https://github.com/deepmodeling/AI4Science101) (👨‍💻 5 · 🔀 14 · ⏱️ 04.09.2022): @@ -436,6 +428,14 @@ This curated list contains 38 awesome open-source projects with a total of 3.7K git clone https://github.com/deepmodeling/tutorials ```
+
docs (🥉5 · ⭐ 3 · 📉) - The home page of DeepModeling documentation. LGPL-3.0 + +- [GitHub](https://github.com/deepmodeling/docs) (👨‍💻 8 · 🔀 7 · ⏱️ 28.10.2024): + + ``` + git clone https://github.com/deepmodeling/docs + ``` +
DeepH-pack (🥉4 · ⭐ 12 · 💤) - Deep neural networks for density functional theory Hamiltonian. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/DeepH-pack) (👨‍💻 6 · 🔀 6 · 📋 6 - 66% open · ⏱️ 28.12.2023): diff --git a/history/2025-01-02_changes.md b/history/2025-01-02_changes.md new file mode 100644 index 0000000..8f42035 --- /dev/null +++ b/history/2025-01-02_changes.md @@ -0,0 +1,15 @@ +## 📈 Trending Up + +_Projects that have a higher project-quality score compared to the last update. There might be a variety of reasons, such as increased downloads or code activity._ + +- APEX (🥈15 · ⭐ 26 · 📈) - APEX: Alloy Properties EXplorer using simulations. LGPL-3.0 +- dpti (🥉10 · ⭐ 22 · 📈) - A Python Package to Automate Thermodynamic Integration Calculations for Free Energy. LGPL-3.0 + +## 📉 Trending Down + +_Projects that have a lower project-quality score compared to the last update. There might be a variety of reasons such as decreased downloads or code activity._ + +- DPGEN2 (🥈16 · ⭐ 33 · 📉) - 2nd generation of the Deep Potential GENerator. LGPL-3.0 +- DMFF (🥈13 · ⭐ 160 · 💤) - DMFF (Differentiable Molecular Force Field) is a Jax-based python package that provides a full differentiable.. LGPL-3.0 +- docs (🥉5 · ⭐ 3 · 📉) - The home page of DeepModeling documentation. LGPL-3.0 + diff --git a/history/2025-01-02_projects.csv b/history/2025-01-02_projects.csv new file mode 100644 index 0000000..d965656 --- /dev/null +++ b/history/2025-01-02_projects.csv @@ -0,0 +1,39 @@ +,name,github_id,pypi_id,conda_id,npm_id,dockerhub_id,github_url,homepage,license,created_at,updated_at,last_commit_pushed_at,commit_count,recent_commit_count,fork_count,watchers_count,pr_count,open_issue_count,closed_issue_count,star_count,latest_stable_release_published_at,latest_stable_release_number,github_release_downloads,monthly_downloads,release_count,description,dependent_project_count,github_dependent_project_count,contributor_count,pypi_url,pypi_monthly_downloads,conda_url,conda_latest_release_published_at,conda_total_downloads,npm_url,npm_monthly_downloads,dockerhub_url,dockerhub_latest_release_published_at,dockerhub_stars,dockerhub_pulls,projectrank,show,category,projectrank_placing,trending +0,DeePMD-kit,deepmodeling/deepmd-kit,deepmd-kit,conda-forge/deepmd-kit,deepmd-kit,deepmodeling/deepmd-kit,https://github.com/deepmodeling/deepmd-kit,https://github.com/deepmodeling/deepmd-kit,LGPL-3.0,2017-12-12 15:23:44,2025-01-02 06:40:23.000000,2024-12-23 20:06:37,3155,166.0,505.0,47.0,2260.0,78.0,773.0,1545.0,2024-12-23 20:14:18,3.0.1,46047.0,36823.0,53.0,A deep learning package for many-body potential energy representation and molecular dynamics.,22.0,22.0,73.0,https://pypi.org/project/deepmd-kit,5972.0,https://anaconda.org/conda-forge/deepmd-kit,2024-12-24 01:42:01.480,1352558.0,https://www.npmjs.com/package/deepmd-kit,15.0,https://hub.docker.com/r/deepmodeling/deepmd-kit,2024-11-25 23:15:53.163662,1.0,3267.0,29,True,others,1.0, +1,ABACUS,deepmodeling/abacus-develop,,conda-forge/abacus,,,https://github.com/deepmodeling/abacus-develop,https://github.com/deepmodeling/abacus-develop,LGPL-3.0,2021-02-01 04:04:52,2025-01-02 09:23:41.000000,2025-01-02 02:06:52,7024,285.0,138.0,11.0,3571.0,129.0,1974.0,178.0,2024-12-27 07:10:23,3.9.0,,14810.0,63.0,An electronic structure package based on either plane wave basis or numerical atomic orbitals.,,,124.0,,,https://anaconda.org/conda-forge/abacus,2024-12-27 20:49:32.966,266596.0,,,,,,,26,True,others,1.0, +2,DP-GEN,deepmodeling/dpgen,dpgen,conda-forge/dpgen,,,https://github.com/deepmodeling/dpgen,https://github.com/deepmodeling/dpgen,LGPL-3.0,2019-06-13 11:43:56,2024-12-24 04:19:40.000000,2024-11-23 07:57:08,2154,13.0,169.0,13.0,866.0,42.0,269.0,318.0,2024-11-23 08:11:47,0.13.0,1859.0,1540.0,19.0,The deep potential generator to generate a deep-learning based model of interatomic potential energy and force field.,7.0,7.0,69.0,https://pypi.org/project/dpgen,871.0,https://anaconda.org/conda-forge/dpgen,2024-11-24 00:26:57.943,35220.0,,,,,,,24,True,others,1.0, +3,dpdata,deepmodeling/dpdata,dpdata,conda-forge/dpdata,,dptechnology/dpdata,https://github.com/deepmodeling/dpdata,https://github.com/deepmodeling/dpdata,LGPL-3.0,2019-04-12 13:24:23,2024-12-27 14:30:38.604000,2024-09-20 18:23:06,761,,128.0,9.0,529.0,19.0,86.0,203.0,2024-09-20 18:24:21,0.2.21,,22164.0,37.0,A Python package for manipulating atomistic data of software in computational science.,132.0,132.0,61.0,https://pypi.org/project/dpdata,20549.0,https://anaconda.org/conda-forge/dpdata,2024-12-27 14:30:38.604,85170.0,,,https://hub.docker.com/r/dptechnology/dpdata,2023-06-02 09:30:14.674068,,639.0,23,True,others,1.0, +4,dpdispatcher,deepmodeling/dpdispatcher,dpdispatcher,conda-forge/dpdispatcher,,dptechnology/dpdispatcher,https://github.com/deepmodeling/dpdispatcher,https://github.com/deepmodeling/dpdispatcher,LGPL-3.0,2020-12-08 05:14:37,2024-12-30 00:54:50.641000,2024-12-23 21:20:54,1101,7.0,54.0,6.0,405.0,18.0,63.0,47.0,2024-08-30 18:52:29,0.6.7,,6185.0,47.0,generate HPC scheduler systems jobs input scripts and submit these scripts to HPC systems and poke until they finish.,53.0,53.0,46.0,https://pypi.org/project/dpdispatcher,3181.0,https://anaconda.org/conda-forge/dpdispatcher,2024-12-30 00:54:50.641,18786.0,,,https://hub.docker.com/r/dptechnology/dpdispatcher,2024-08-30 18:56:38.463169,,114408.0,22,True,others,2.0, +5,reacnetgenerator,deepmodeling/reacnetgenerator,reacnetgenerator,conda-forge/reacnetgenerator,,,https://github.com/deepmodeling/reacnetgenerator,https://github.com/deepmodeling/reacnetgenerator,LGPL-3.0,2018-04-06 15:07:56,2024-12-23 22:35:27.000000,2024-12-23 21:55:49,2508,10.0,39.0,9.0,2169.0,7.0,120.0,70.0,2024-10-03 19:33:36,1.6.14,,12341.0,100.0,an automatic reaction network generator for reactive molecular dynamics simulation.,3.0,3.0,18.0,https://pypi.org/project/reacnetgenerator,3785.0,https://anaconda.org/conda-forge/reacnetgenerator,2024-10-04 04:12:50.002,479165.0,,,,,,,21,True,others,2.0, +6,dargs,deepmodeling/dargs,dargs,conda-forge/dargs,,,https://github.com/deepmodeling/dargs,https://github.com/deepmodeling/dargs,LGPL-3.0,2020-09-19 22:20:28,2024-12-23 22:33:27.000000,2024-11-27 22:17:30,161,10.0,3.0,7.0,79.0,2.0,7.0,5.0,2024-11-21 03:25:26,0.4.10,,44446.0,31.0,Argument processing for the deep modeling project.,130.0,130.0,7.0,https://pypi.org/project/dargs,43632.0,https://anaconda.org/conda-forge/dargs,2024-12-22 08:33:55.288,36645.0,,,,,,,19,True,others,2.0, +7,dflow,deepmodeling/dflow,dflow,conda-forge/dflow,,dptechnology/dflow,https://github.com/deepmodeling/dflow,https://github.com/deepmodeling/dflow,LGPL-3.0,2022-01-21 08:14:36,2024-12-06 06:45:08.006324,2024-12-06 06:43:08,2144,42.0,26.0,1.0,850.0,14.0,22.0,66.0,2024-12-06 06:43:37,1.8.102,,298.0,100.0,Dflow is a Python framework for constructing scientific computing workflows (e.g. concurrent learning workflows)..,,,22.0,https://pypi.org/project/dflow,,https://anaconda.org/conda-forge/dflow,,,,,https://hub.docker.com/r/dptechnology/dflow,2024-12-06 06:45:08.006324,,10743.0,18,True,others,2.0, +8,DPGEN2,deepmodeling/dpgen2,dpgen2,,,dptechnology/dpgen2,https://github.com/deepmodeling/dpgen2,https://github.com/deepmodeling/dpgen2,LGPL-3.0,2022-02-28 02:41:16,2024-12-03 04:08:02.461223,2024-12-03 04:04:52,327,9.0,26.0,7.0,236.0,11.0,23.0,33.0,2023-01-28 03:43:25,0.0.7,,364.0,7.0,2nd generation of the Deep Potential GENerator.,5.0,5.0,14.0,https://pypi.org/project/dpgen2,257.0,,,,,,https://hub.docker.com/r/dptechnology/dpgen2,2024-12-03 04:08:02.461223,,3757.0,16,True,others,2.0,-1.0 +9,DeepFlame,deepmodeling/deepflame-dev,,,,,https://github.com/deepmodeling/deepflame-dev,https://github.com/deepmodeling/deepflame-dev,GPL-3.0,2022-06-12 10:25:12,2024-12-06 06:00:03.000000,2024-11-23 04:28:17,1117,4.0,63.0,6.0,478.0,20.0,29.0,145.0,2024-08-23 01:31:45,1.4,,,20.0,A deep learning empowered open-source platform for reacting flow simulations.,,,24.0,,,,,,,,,,,,15,True,others,2.0, +10,DeePTB,deepmodeling/DeePTB,dptb,,,,https://github.com/deepmodeling/DeePTB,https://github.com/deepmodeling/DeePTB,LGPL-3.0,2023-07-11 03:19:42,2025-01-01 03:36:51.000000,2025-01-01 03:36:51,756,8.0,16.0,3.0,179.0,9.0,29.0,59.0,2024-08-15 03:02:38,2.1.1,,240.0,11.0,DeePTB: A deep learning package for tight-binding approach with ab initio accuracy.,2.0,2.0,10.0,https://pypi.org/project/dptb,240.0,,,,,,,,,,15,True,others,2.0, +11,APEX,deepmodeling/APEX,apex-flow,,,,https://github.com/deepmodeling/APEX,https://github.com/deepmodeling/APEX,LGPL-3.0,2023-04-20 06:13:42,2024-11-18 02:34:26.000000,2024-10-25 03:40:57,591,7.0,18.0,7.0,78.0,1.0,8.0,26.0,2024-05-06 10:01:52,1.2.0,,1247.0,4.0,APEX: Alloy Properties EXplorer using simulations.,3.0,3.0,6.0,https://pypi.org/project/apex-flow,1247.0,,,,,,,,,,15,True,others,2.0,1.0 +12,DP-GUI,deepmodeling/dpgui,dpgui,,,,https://github.com/deepmodeling/dpgui,https://github.com/deepmodeling/dpgui,LGPL-3.0,2021-07-21 18:48:23,2024-12-30 23:12:47.000000,2024-12-30 23:08:54,321,15.0,5.0,6.0,499.0,,1.0,7.0,2024-11-17 07:05:49,1.0.1.post0,,16353.0,5.0,A web-based GUI for user inputs.,9.0,9.0,4.0,https://pypi.org/project/dpgui,16353.0,,,,,,,,,,15,True,others,2.0, +13,JAX-FEM,deepmodeling/jax-fem,jax-fem,,,,https://github.com/deepmodeling/jax-fem,https://github.com/deepmodeling/jax-fem,GPL-3.0,2023-10-02 15:20:54,2024-12-13 08:09:13.000000,2024-12-13 08:09:10,209,7.0,46.0,12.0,6.0,25.0,16.0,319.0,,,,334.0,,Differentiable Finite Element Method with JAX.,3.0,3.0,9.0,https://pypi.org/project/jax-fem,334.0,,,,,,,,,,14,True,others,2.0, +14,DMFF,deepmodeling/DMFF,,conda-forge/dmff,,,https://github.com/deepmodeling/DMFF,https://github.com/deepmodeling/DMFF,LGPL-3.0,2022-02-14 01:35:50,2024-10-19 08:37:14.000000,2024-01-12 00:58:20,431,,45.0,9.0,165.0,11.0,16.0,161.0,2023-11-09 14:32:37,1.0.0,,111.0,4.0,DMFF (Differentiable Molecular Force Field) is a Jax-based python package that provides a full differentiable..,,,14.0,,,https://anaconda.org/conda-forge/dmff,2024-01-06 07:33:02.470,1334.0,,,,,,,13,True,others,2.0,-1.0 +15,rid-kit,deepmodeling/rid-kit,rid-kit,,,,https://github.com/deepmodeling/rid-kit,https://github.com/deepmodeling/rid-kit,LGPL-3.0,2021-02-02 02:44:00,2024-06-27 07:19:30.000000,2024-06-27 07:19:24,475,,23.0,5.0,21.0,2.0,3.0,46.0,2024-05-14 03:25:35,0.6.4,148.0,261.0,5.0,Reinforced dynamics.,2.0,2.0,14.0,https://pypi.org/project/rid-kit,258.0,,,,,,,,,,13,True,others,2.0, +16,deepmodeling_sphinx,deepmodeling/deepmodeling_sphinx,deepmodeling_sphinx,,,,https://github.com/deepmodeling/deepmodeling_sphinx,https://github.com/deepmodeling/deepmodeling_sphinx,LGPL-3.0,2022-03-04 00:19:06,2024-12-23 22:33:17.000000,2024-10-27 22:37:03,76,3.0,7.0,5.0,68.0,,,3.0,2024-10-27 22:37:32,0.3.0,,2311.0,24.0,Sphinx extension for DeepModeling projects.,,,7.0,https://pypi.org/project/deepmodeling_sphinx,2311.0,,,,,,,,,,13,True,others,2.0, +17,GPUMD,deepmodeling/GPUMD,,,,,https://github.com/deepmodeling/GPUMD,https://github.com/deepmodeling/GPUMD,GPL-3.0,2024-06-18 05:40:21,2024-12-26 19:47:38.000000,2024-12-26 19:30:37,4330,303.0,,,,,,4.0,,,,,,Graphics Processing Units Molecular Dynamics.,,,41.0,,,,,,,,,,,,12,True,others,3.0, +18,args,deepmodeling/args,,,@deepmodeling/args,,https://github.com/deepmodeling/args,https://github.com/deepmodeling/args,LGPL-3.0,2021-12-27 03:27:24,2024-12-30 23:07:49.000000,2024-12-30 23:07:48,79,5.0,2.0,6.0,51.0,,,2.0,2024-12-12 01:19:43,0.1.0,,235.0,17.0,DeepModeling dargs arguments generation.,5.0,5.0,3.0,,,,,,https://www.npmjs.com/package/@deepmodeling/args,235.0,,,,,11,True,others,3.0, +19,dpti,deepmodeling/dpti,dpti,,,,https://github.com/deepmodeling/dpti,https://github.com/deepmodeling/dpti,LGPL-3.0,2021-04-04 13:57:37,2024-12-30 23:51:32.000000,2024-12-30 23:51:31,429,13.0,19.0,7.0,76.0,9.0,1.0,22.0,,,,95.0,,A Python Package to Automate Thermodynamic Integration Calculations for Free Energy.,2.0,2.0,18.0,https://pypi.org/project/dpti,95.0,,,,,,,,,,10,True,others,3.0,1.0 +20,DeePKS-kit,deepmodeling/deepks-kit,,,,,https://github.com/deepmodeling/deepks-kit,https://github.com/deepmodeling/deepks-kit,LGPL-3.0,2020-07-29 03:27:50,2024-09-28 05:44:36.000000,2024-04-13 03:44:40,384,,36.0,14.0,47.0,10.0,14.0,104.0,,,,,,a package for developing machine learning-based chemically accurate energy and density functional models.,,,7.0,,,,,,,,,,,,9,True,others,3.0, +21,Blog,deepmodeling/blog,,,,,https://github.com/deepmodeling/blog,https://github.com/deepmodeling/blog,LGPL-3.0,2021-06-10 23:11:55,2025-01-02 01:16:29.000000,2025-01-02 01:16:27,276,99.0,8.0,6.0,210.0,,,1.0,,,,,,DeepModeling Blog.,,,9.0,,,,,,,,,,,,9,True,others,3.0, +22,AIS-Square,deepmodeling/AIS-Square,,,,,https://github.com/deepmodeling/AIS-Square,https://github.com/deepmodeling/AIS-Square,LGPL-3.0,2022-09-13 09:52:30,2024-12-28 13:38:06.000000,2024-12-28 13:38:06,754,88.0,8.0,8.0,210.0,5.0,1.0,13.0,,,,,,,,,8.0,,,,,,,,,,,,8,True,others,3.0, +23,DeePDih,deepmodeling/DeePDih,,,,,https://github.com/deepmodeling/DeePDih,https://github.com/deepmodeling/DeePDih,MIT,2024-03-03 13:22:19,2024-12-21 09:53:32.000000,2024-04-19 07:37:47,61,,3.0,2.0,,,,5.0,2024-12-21 09:53:32,dpa-2-gfn2-xtb-tblite,,,1.0,Deep Potential driven molecular dihedral scan toolkit.,,,,,,,,,,,,,,,8,True,others,3.0, +24,fealpy,deepmodeling/fealpy,fealpy,,,,https://github.com/deepmodeling/fealpy,https://github.com/deepmodeling/fealpy,,2023-04-10 03:58:57,2024-04-24 03:09:27.000000,2024-04-24 01:36:31,6125,,2.0,1.0,1.0,,,5.0,,,,650.0,,Finite Element Analysis Library in Python.,,,57.0,https://pypi.org/project/fealpy,650.0,,,,,,,,,,8,True,others,3.0, +25,fpop,deepmodeling/fpop,fpop,,,,https://github.com/deepmodeling/fpop,https://github.com/deepmodeling/fpop,LGPL-3.0,2023-02-10 03:16:47,2024-07-01 09:11:36.000000,2024-07-01 09:11:36,42,,13.0,9.0,25.0,4.0,,2.0,,,,559.0,,,11.0,11.0,4.0,https://pypi.org/project/fpop,559.0,,,,,,,,,,8,True,others,3.0, +26,Uni-Fold,deepmodeling/Uni-Fold,,,,dptechnology/unifold,https://github.com/deepmodeling/Uni-Fold,https://github.com/deepmodeling/Uni-Fold,Apache-2.0,2021-12-07 14:40:37,2024-04-11 02:15:21.000000,2022-08-18 15:27:32,29,,18.0,5.0,2.0,,1.0,92.0,,,,21.0,,,,,3.0,,,,,,,,https://hub.docker.com/r/dptechnology/unifold,2024-01-08 06:24:09.367953,,810.0,7,True,others,3.0, +27,community,deepmodeling/community,,,,,https://github.com/deepmodeling/community,https://github.com/deepmodeling/community,,2021-05-06 04:50:02,2024-09-26 09:19:17.000000,2024-09-26 09:19:17,137,,21.0,11.0,43.0,,2.0,85.0,,,,,,DeepModeling community content.,,,17.0,,,,,,,,,,,,6,True,others,3.0, +28,tbplas,deepmodeling/tbplas,,,,,https://github.com/deepmodeling/tbplas,https://github.com/deepmodeling/tbplas,,2024-02-29 03:21:24,2024-04-11 02:16:51.000000,2024-01-17 13:25:05,662,,4.0,9.0,2.0,2.0,,9.0,2024-03-01 09:33:35,1.6,,,1.0,Repository of TBPLaS (tight-binding package for large-scale simulation).,,,10.0,,,,,,,,,,,,6,True,others,3.0, +29,AI4Science101,deepmodeling/AI4Science101,,,,,https://github.com/deepmodeling/AI4Science101,https://github.com/deepmodeling/AI4Science101,,2022-06-19 02:26:48,2024-04-11 02:15:55.000000,2022-09-04 02:06:18,139,,14.0,9.0,29.0,,1.0,86.0,,,,,,AI for Science.,,,5.0,,,,,,,,,,,,5,True,others,3.0, +30,tutorials,deepmodeling/tutorials,,,,,https://github.com/deepmodeling/tutorials,https://github.com/deepmodeling/tutorials,,2022-03-07 06:19:19,2024-08-21 19:01:45.000000,2024-08-21 19:01:44,143,,23.0,5.0,67.0,1.0,2.0,14.0,,,,,,Tutorials for DeepModeling projects.,,,10.0,,,,,,,,,,,,5,True,others,3.0, +31,docs,deepmodeling/docs,,,,,https://github.com/deepmodeling/docs,https://github.com/deepmodeling/docs,LGPL-3.0,2021-07-05 00:32:29,2024-10-28 21:42:38.000000,2024-10-28 21:42:38,28,1.0,7.0,5.0,24.0,,,3.0,,,,,,The home page of DeepModeling documentation.,,,8.0,,,,,,,,,,,,5,True,others,3.0,-1.0 +32,DeepH-pack,deepmodeling/DeepH-pack,,,,,https://github.com/deepmodeling/DeepH-pack,https://github.com/deepmodeling/DeepH-pack,LGPL-3.0,2022-07-19 08:07:24,2024-04-11 02:16:01.000000,2023-12-28 12:48:09,56,,6.0,2.0,2.0,4.0,2.0,12.0,,,,,,Deep neural networks for density functional theory Hamiltonian.,,,6.0,,,,,,,,,,,,4,True,others,3.0, +33,ADMP,deepmodeling/ADMP,,,,,https://github.com/deepmodeling/ADMP,https://github.com/deepmodeling/ADMP,,2021-12-26 07:22:47,2024-04-11 02:15:25.000000,2022-02-15 02:13:59,120,,3.0,1.0,6.0,,,3.0,,,,,,Automatic Differentiation Multipole Moment Molecular Forcefield.,,,7.0,,,,,,,,,,,,4,True,others,3.0, +34,tutorials-cn,deepmodeling/tutorials-cn,,,,,https://github.com/deepmodeling/tutorials-cn,https://github.com/deepmodeling/tutorials-cn,LGPL-2.1,2022-03-30 07:39:32,2024-04-11 02:15:41.000000,2022-12-29 11:58:55,9,,7.0,5.0,13.0,,,3.0,,,,,,,,,4.0,,,,,,,,,,,,4,True,others,3.0, +35,LibRI,deepmodeling/LibRI,,,,,https://github.com/deepmodeling/LibRI,https://github.com/deepmodeling/LibRI,GPL-3.0,2023-04-19 02:10:20,2024-04-11 02:16:14.000000,2023-04-10 15:53:42,80,,1.0,2.0,1.0,2.0,1.0,6.0,,,,,,,,,2.0,,,,,,,,,,,,1,True,others,3.0, +36,openfinite,deepmodeling/openfinite,,,,,https://github.com/deepmodeling/openfinite,https://github.com/deepmodeling/openfinite,LGPL-3.0,2021-10-10 08:56:48,2024-04-11 02:15:14.000000,2021-10-06 08:13:39,13,,1.0,1.0,1.0,,,1.0,,,,,,,,,2.0,,,,,,,,,,,,0,True,others,, +37,dflow-op-cutter,deepmodeling/dflow-op-cutter,,,,,https://github.com/deepmodeling/dflow-op-cutter,https://github.com/deepmodeling/dflow-op-cutter,,2022-06-24 01:31:42,2024-04-11 02:15:58.000000,2022-07-06 09:54:08,4,,1.0,4.0,1.0,,1.0,,,,,,,,,,2.0,,,,,,,,,,,,0,True,others,, diff --git a/latest-changes.md b/latest-changes.md index 0470034..8f42035 100644 --- a/latest-changes.md +++ b/latest-changes.md @@ -2,13 +2,14 @@ _Projects that have a higher project-quality score compared to the last update. There might be a variety of reasons, such as increased downloads or code activity._ -- DeePDih (🥉8 · ⭐ 5 · 💤) - Deep Potential driven molecular dihedral scan toolkit. MIT +- APEX (🥈15 · ⭐ 26 · 📈) - APEX: Alloy Properties EXplorer using simulations. LGPL-3.0 +- dpti (🥉10 · ⭐ 22 · 📈) - A Python Package to Automate Thermodynamic Integration Calculations for Free Energy. LGPL-3.0 ## 📉 Trending Down _Projects that have a lower project-quality score compared to the last update. There might be a variety of reasons such as decreased downloads or code activity._ -- dargs (🥈19 · ⭐ 5 · 📉) - Argument processing for the deep modeling project. LGPL-3.0 -- JAX-FEM (🥈14 · ⭐ 320 · 📉) - Differentiable Finite Element Method with JAX. GPL-3.0 -- APEX (🥈14 · ⭐ 25 · 📉) - APEX: Alloy Properties EXplorer using simulations. LGPL-3.0 +- DPGEN2 (🥈16 · ⭐ 33 · 📉) - 2nd generation of the Deep Potential GENerator. LGPL-3.0 +- DMFF (🥈13 · ⭐ 160 · 💤) - DMFF (Differentiable Molecular Force Field) is a Jax-based python package that provides a full differentiable.. LGPL-3.0 +- docs (🥉5 · ⭐ 3 · 📉) - The home page of DeepModeling documentation. LGPL-3.0