From 23fbb9ff737290977f8c717c7be5f2926e608d18 Mon Sep 17 00:00:00 2001 From: njzjz Date: Thu, 14 Nov 2024 18:19:31 +0000 Subject: [PATCH] Update best-of list for version 2024.11.14 --- README.md | 114 ++++++++++++++++---------------- history/2024-11-14_changes.md | 12 ++++ history/2024-11-14_projects.csv | 39 +++++++++++ latest-changes.md | 9 +-- 4 files changed, 110 insertions(+), 64 deletions(-) create mode 100644 history/2024-11-14_changes.md create mode 100644 history/2024-11-14_projects.csv diff --git a/README.md b/README.md index efad02b..121fd4d 100644 --- a/README.md +++ b/README.md @@ -15,7 +15,7 @@

-This curated list contains 38 awesome open-source projects with a total of 3.5K stars grouped into 0 categories. All projects are ranked by a project-quality score, which is calculated based on various metrics automatically collected from GitHub and different package managers. If you like to add or update projects, feel free to open an [issue](https://github.com/deepmodeling/deepmodeling-projects/issues/new/choose), submit a [pull request](https://github.com/deepmodeling/deepmodeling-projects/pulls), or directly edit the [projects.yaml](https://github.com/deepmodeling/deepmodeling-projects/edit/main/projects.yaml). Contributions are very welcome! +This curated list contains 38 awesome open-source projects with a total of 3.6K stars grouped into 0 categories. All projects are ranked by a project-quality score, which is calculated based on various metrics automatically collected from GitHub and different package managers. If you like to add or update projects, feel free to open an [issue](https://github.com/deepmodeling/deepmodeling-projects/issues/new/choose), submit a [pull request](https://github.com/deepmodeling/deepmodeling-projects/pulls), or directly edit the [projects.yaml](https://github.com/deepmodeling/deepmodeling-projects/edit/main/projects.yaml). Contributions are very welcome! > 🧙‍♂️ Discover other [best-of lists](https://best-of.org) or [create your own](https://github.com/best-of-lists/best-of/blob/main/create-best-of-list.md). @@ -46,12 +46,12 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K
DeePMD-kit (🥇26 · ⭐ 1.5K) - A deep learning package for many-body potential energy representation and molecular dynamics. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/deepmd-kit) (👨‍💻 69 · 🔀 490 · 📥 42K · 📦 20 · 📋 810 - 9% open · ⏱️ 17.09.2024): +- [GitHub](https://github.com/deepmodeling/deepmd-kit) (👨‍💻 69 · 🔀 490 · 📥 43K · 📦 20 · 📋 820 - 8% open · ⏱️ 17.09.2024): ``` git clone https://github.com/deepmodeling/deepmd-kit ``` -- [PyPi](https://pypi.org/project/deepmd-kit) (📥 10K / month): +- [PyPi](https://pypi.org/project/deepmd-kit) (📥 8.4K / month): ``` pip install deepmd-kit ``` @@ -59,7 +59,7 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K ``` conda install -c conda-forge deepmd-kit ``` -- [npm](https://www.npmjs.com/package/deepmd-kit) (📥 5 / month): +- [npm](https://www.npmjs.com/package/deepmd-kit) (📥 6 / month): ``` npm install deepmd-kit ``` @@ -70,12 +70,12 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K
ABACUS (🥇26 · ⭐ 170) - 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 · 🔀 130 · 📋 2K - 7% open · ⏱️ 07.11.2024): +- [GitHub](https://github.com/deepmodeling/abacus-develop) (👨‍💻 120 · 🔀 130 · 📋 2K - 7% open · ⏱️ 14.11.2024): ``` git clone https://github.com/deepmodeling/abacus-develop ``` -- [Conda](https://anaconda.org/conda-forge/abacus) (📥 220K · ⏱️ 07.11.2024): +- [Conda](https://anaconda.org/conda-forge/abacus) (📥 230K · ⏱️ 10.11.2024): ``` conda install -c conda-forge abacus ``` @@ -87,7 +87,7 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K ``` git clone https://github.com/deepmodeling/dpdata ``` -- [PyPi](https://pypi.org/project/dpdata) (📥 71K / month): +- [PyPi](https://pypi.org/project/dpdata) (📥 75K / month): ``` pip install dpdata ``` @@ -100,18 +100,18 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K docker pull dptechnology/dpdata ```
-
dpdispatcher (🥇24 · ⭐ 44) - generate HPC scheduler systems jobs input scripts and submit these scripts to HPC systems and poke until they finish. LGPL-3.0 +
dpdispatcher (🥇24 · ⭐ 45) - 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) (👨‍💻 47 · 🔀 54 · 📦 52 · 📋 79 - 20% open · ⏱️ 28.10.2024): +- [GitHub](https://github.com/deepmodeling/dpdispatcher) (👨‍💻 47 · 🔀 54 · 📦 53 · 📋 79 - 20% open · ⏱️ 28.10.2024): ``` git clone https://github.com/deepmodeling/dpdispatcher ``` -- [PyPi](https://pypi.org/project/dpdispatcher) (📥 6.8K / month): +- [PyPi](https://pypi.org/project/dpdispatcher) (📥 5.5K / month): ``` pip install dpdispatcher ``` -- [Conda](https://anaconda.org/conda-forge/dpdispatcher) (📥 16K · ⏱️ 31.08.2024): +- [Conda](https://anaconda.org/conda-forge/dpdispatcher) (📥 17K · ⏱️ 31.08.2024): ``` conda install -c conda-forge dpdispatcher ``` @@ -120,39 +120,39 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K docker pull dptechnology/dpdispatcher ```
-
DP-GEN (🥈21 · ⭐ 310 · 📉) - The deep potential generator to generate a deep-learning based model of interatomic potential energy and force field. LGPL-3.0 +
DP-GEN (🥈21 · ⭐ 310) - The deep potential generator to generate a deep-learning based model of interatomic potential energy and force field. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/dpgen) (👨‍💻 65 · 🔀 170 · 📥 1.8K · 📦 7 · 📋 300 - 11% open · ⏱️ 04.11.2024): ``` git clone https://github.com/deepmodeling/dpgen ``` -- [PyPi](https://pypi.org/project/dpgen) (📥 1.5K / month): +- [PyPi](https://pypi.org/project/dpgen) (📥 1.3K / month): ``` pip install dpgen ``` -- [Conda](https://anaconda.org/conda-forge/dpgen) (📥 33K · ⏱️ 10.04.2024): +- [Conda](https://anaconda.org/conda-forge/dpgen) (📥 34K · ⏱️ 10.04.2024): ``` conda install -c conda-forge dpgen ```
reacnetgenerator (🥈21 · ⭐ 67) - an automatic reaction network generator for reactive molecular dynamics simulation. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/reacnetgenerator) (👨‍💻 18 · 🔀 39 · 📦 3 · 📋 120 - 4% open · ⏱️ 31.10.2024): +- [GitHub](https://github.com/deepmodeling/reacnetgenerator) (👨‍💻 18 · 🔀 39 · 📦 3 · 📋 120 - 4% open · ⏱️ 12.11.2024): ``` git clone https://github.com/deepmodeling/reacnetgenerator ``` -- [PyPi](https://pypi.org/project/reacnetgenerator) (📥 6.5K / month): +- [PyPi](https://pypi.org/project/reacnetgenerator) (📥 5.8K / month): ``` pip install reacnetgenerator ``` -- [Conda](https://anaconda.org/conda-forge/reacnetgenerator) (📥 440K · ⏱️ 04.10.2024): +- [Conda](https://anaconda.org/conda-forge/reacnetgenerator) (📥 450K · ⏱️ 04.10.2024): ``` conda install -c conda-forge reacnetgenerator ```
-
dflow (🥈19 · ⭐ 64) - Dflow is a Python framework for constructing scientific computing workflows (e.g. concurrent learning workflows).. LGPL-3.0 +
dflow (🥈19 · ⭐ 65) - Dflow is a Python framework for constructing scientific computing workflows (e.g. concurrent learning workflows).. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/dflow) (👨‍💻 22 · 🔀 26 · 📋 35 - 40% open · ⏱️ 31.10.2024): @@ -172,25 +172,25 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K docker pull dptechnology/dflow ```
-
dargs (🥈18 · ⭐ 5 · 📈) - Argument processing for the deep modeling project. LGPL-3.0 +
dargs (🥈18 · ⭐ 5) - Argument processing for the deep modeling project. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dargs) (👨‍💻 7 · 🔀 3 · 📦 130 · 📋 8 - 25% open · ⏱️ 28.10.2024): +- [GitHub](https://github.com/deepmodeling/dargs) (👨‍💻 7 · 🔀 3 · 📦 130 · 📋 9 - 33% open · ⏱️ 28.10.2024): ``` git clone https://github.com/deepmodeling/dargs ``` -- [PyPi](https://pypi.org/project/dargs) (📥 71K / month): +- [PyPi](https://pypi.org/project/dargs) (📥 99K / month): ``` pip install dargs ``` -- [Conda](https://anaconda.org/conda-forge/dargs) (📥 33K · ⏱️ 15.07.2024): +- [Conda](https://anaconda.org/conda-forge/dargs) (📥 34K · ⏱️ 15.07.2024): ``` conda install -c conda-forge dargs ```
DeepFlame (🥈17 · ⭐ 140) - A deep learning empowered open-source platform for reacting flow simulations. GPL-3.0 -- [GitHub](https://github.com/deepmodeling/deepflame-dev) (👨‍💻 24 · 🔀 61 · 📋 48 - 39% open · ⏱️ 03.11.2024): +- [GitHub](https://github.com/deepmodeling/deepflame-dev) (👨‍💻 24 · 🔀 61 · 📋 49 - 40% open · ⏱️ 03.11.2024): ``` git clone https://github.com/deepmodeling/deepflame-dev @@ -198,12 +198,12 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K
DPGEN2 (🥈17 · ⭐ 33) - 2nd generation of the Deep Potential GENerator. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dpgen2) (👨‍💻 14 · 🔀 25 · 📦 5 · 📋 32 - 28% open · ⏱️ 29.10.2024): +- [GitHub](https://github.com/deepmodeling/dpgen2) (👨‍💻 14 · 🔀 26 · 📦 5 · 📋 33 - 30% open · ⏱️ 29.10.2024): ``` git clone https://github.com/deepmodeling/dpgen2 ``` -- [PyPi](https://pypi.org/project/dpgen2) (📥 640 / month): +- [PyPi](https://pypi.org/project/dpgen2) (📥 510 / month): ``` pip install dpgen2 ``` @@ -212,40 +212,40 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K docker pull dptechnology/dpgen2 ```
-
DeePTB (🥈16 · ⭐ 54) - DeePTB: A deep learning package for tight-binding approach with ab initio accuracy. LGPL-3.0 +
APEX (🥈16 · ⭐ 24 · 📈) - APEX: Alloy Properties EXplorer using simulations. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/DeePTB) (👨‍💻 10 · 🔀 16 · 📦 2 · 📋 38 - 26% open · ⏱️ 03.10.2024): +- [GitHub](https://github.com/deepmodeling/APEX) (👨‍💻 6 · 🔀 16 · 📦 3 · ⏱️ 25.10.2024): ``` - git clone https://github.com/deepmodeling/DeePTB + git clone https://github.com/deepmodeling/APEX ``` -- [PyPi](https://pypi.org/project/dptb) (📥 600 / month): +- [PyPi](https://pypi.org/project/apex-flow) (📥 5.6K / month): ``` - pip install dptb + pip install apex-flow ```
-
JAX-FEM (🥈15 · ⭐ 280) - Differentiable Finite Element Method with JAX. GPL-3.0 +
JAX-FEM (🥈15 · ⭐ 290) - Differentiable Finite Element Method with JAX. GPL-3.0 -- [GitHub](https://github.com/deepmodeling/jax-fem) (👨‍💻 8 · 🔀 43 · 📦 3 · 📋 35 - 62% open · ⏱️ 30.10.2024): +- [GitHub](https://github.com/deepmodeling/jax-fem) (👨‍💻 8 · 🔀 44 · 📦 3 · 📋 37 - 62% open · ⏱️ 30.10.2024): ``` git clone https://github.com/deepmodeling/jax-fem ``` -- [PyPi](https://pypi.org/project/jax-fem) (📥 730 / month): +- [PyPi](https://pypi.org/project/jax-fem) (📥 570 / month): ``` pip install jax-fem ```
-
APEX (🥈15 · ⭐ 23 · 📉) - APEX: Alloy Properties EXplorer using simulations. LGPL-3.0 +
DeePTB (🥈15 · ⭐ 54 · 📉) - DeePTB: A deep learning package for tight-binding approach with ab initio accuracy. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/APEX) (👨‍💻 6 · 🔀 16 · 📦 2 · ⏱️ 25.10.2024): +- [GitHub](https://github.com/deepmodeling/DeePTB) (👨‍💻 10 · 🔀 16 · 📦 2 · 📋 38 - 26% open · ⏱️ 03.10.2024): ``` - git clone https://github.com/deepmodeling/APEX + git clone https://github.com/deepmodeling/DeePTB ``` -- [PyPi](https://pypi.org/project/apex-flow) (📥 6.6K / month): +- [PyPi](https://pypi.org/project/dptb) (📥 480 / month): ``` - pip install apex-flow + pip install dptb ```
DMFF (🥈14 · ⭐ 150 · 💤) - DMFF (Differentiable Molecular Force Field) is a Jax-based python package that provides a full differentiable.. LGPL-3.0 @@ -255,19 +255,19 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K ``` git clone https://github.com/deepmodeling/DMFF ``` -- [Conda](https://anaconda.org/conda-forge/dmff) (📥 1.1K · ⏱️ 06.01.2024): +- [Conda](https://anaconda.org/conda-forge/dmff) (📥 1.2K · ⏱️ 06.01.2024): ``` conda install -c conda-forge dmff ```
-
rid-kit (🥈13 · ⭐ 44 · 📉) - Reinforced dynamics. LGPL-3.0 +
rid-kit (🥈13 · ⭐ 44) - Reinforced dynamics. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/rid-kit) (👨‍💻 14 · 🔀 22 · 📥 140 · 📦 2 · 📋 4 - 25% open · ⏱️ 27.06.2024): ``` git clone https://github.com/deepmodeling/rid-kit ``` -- [PyPi](https://pypi.org/project/rid-kit) (📥 730 / month): +- [PyPi](https://pypi.org/project/rid-kit) (📥 440 / month): ``` pip install rid-kit ``` @@ -279,7 +279,7 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K ``` git clone https://github.com/deepmodeling/dpgui ``` -- [PyPi](https://pypi.org/project/dpgui) (📥 40K / month): +- [PyPi](https://pypi.org/project/dpgui) (📥 49K / month): ``` pip install dpgui ``` @@ -291,14 +291,14 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K ``` git clone https://github.com/deepmodeling/deepmodeling_sphinx ``` -- [PyPi](https://pypi.org/project/deepmodeling_sphinx) (📥 4.6K / month): +- [PyPi](https://pypi.org/project/deepmodeling_sphinx) (📥 4.7K / month): ``` pip install deepmodeling_sphinx ```
GPUMD (🥉11 · ⭐ 3 · 🐣) - Graphics Processing Units Molecular Dynamics. GPL-3.0 -- [GitHub](https://github.com/deepmodeling/GPUMD) (👨‍💻 35 · ⏱️ 30.10.2024): +- [GitHub](https://github.com/deepmodeling/GPUMD) (👨‍💻 37 · ⏱️ 30.10.2024): ``` git clone https://github.com/deepmodeling/GPUMD @@ -312,31 +312,31 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K git clone https://github.com/deepmodeling/deepks-kit ```
-
dpti (🥉10 · ⭐ 22 · 📉) - A Python Package to Automate Thermodynamic Integration Calculations for Free Energy. 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/dpti) (👨‍💻 19 · 🔀 19 · 📦 2 · ⏱️ 14.08.2024): +- [GitHub](https://github.com/deepmodeling/dpti) (👨‍💻 19 · 🔀 19 · 📦 2 · 📋 9 - 88% open · ⏱️ 11.11.2024): ``` git clone https://github.com/deepmodeling/dpti ``` -- [PyPi](https://pypi.org/project/dpti) (📥 270 / month): +- [PyPi](https://pypi.org/project/dpti) (📥 210 / month): ``` pip install dpti ```
fpop (🥉9 · ⭐ 2) - LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/fpop) (👨‍💻 4 · 🔀 12 · 📦 10 · ⏱️ 01.07.2024): +- [GitHub](https://github.com/deepmodeling/fpop) (👨‍💻 4 · 🔀 12 · 📦 11 · ⏱️ 01.07.2024): ``` git clone https://github.com/deepmodeling/fpop ``` -- [PyPi](https://pypi.org/project/fpop) (📥 2.3K / month): +- [PyPi](https://pypi.org/project/fpop) (📥 1.7K / month): ``` pip install fpop ```
-
community (🥉8 · ⭐ 82) - DeepModeling community content. Unlicensed +
community (🥉8 · ⭐ 83) - DeepModeling community content. Unlicensed - [GitHub](https://github.com/deepmodeling/community) (👨‍💻 17 · 🔀 21 · ⏱️ 26.09.2024): @@ -351,7 +351,7 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K ``` git clone https://github.com/deepmodeling/fealpy ``` -- [PyPi](https://pypi.org/project/fealpy) (📥 480 / month): +- [PyPi](https://pypi.org/project/fealpy) (📥 330 / month): ``` pip install fealpy ``` @@ -363,14 +363,14 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K ``` git clone https://github.com/deepmodeling/args ``` -- [npm](https://www.npmjs.com/package/@deepmodeling/args) (📥 65 / month): +- [npm](https://www.npmjs.com/package/@deepmodeling/args) (📥 61 / month): ``` npm install @deepmodeling/args ```
-
Blog (🥉8 · ⭐ 1 · 📈) - DeepModeling Blog. LGPL-3.0 +
Blog (🥉8 · ⭐ 1) - DeepModeling Blog. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/blog) (👨‍💻 8 · 🔀 8 · ⏱️ 07.11.2024): +- [GitHub](https://github.com/deepmodeling/blog) (👨‍💻 8 · 🔀 8 · ⏱️ 14.11.2024): ``` git clone https://github.com/deepmodeling/blog @@ -383,7 +383,7 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K ``` git clone https://github.com/deepmodeling/Uni-Fold ``` -- [Docker Hub](https://hub.docker.com/r/dptechnology/unifold) (📥 770 · ⏱️ 08.01.2024): +- [Docker Hub](https://hub.docker.com/r/dptechnology/unifold) (📥 780 · ⏱️ 08.01.2024): ``` docker pull dptechnology/unifold ``` @@ -428,9 +428,9 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K git clone https://github.com/deepmodeling/AI4Science101 ```
-
tutorials (🥉4 · ⭐ 13 · 📉) - Tutorials for DeepModeling projects. Unlicensed +
tutorials (🥉4 · ⭐ 14) - Tutorials for DeepModeling projects. Unlicensed -- [GitHub](https://github.com/deepmodeling/tutorials) (👨‍💻 10 · 🔀 22 · 📋 3 - 33% open · ⏱️ 21.08.2024): +- [GitHub](https://github.com/deepmodeling/tutorials) (👨‍💻 10 · 🔀 23 · 📋 3 - 33% open · ⏱️ 21.08.2024): ``` git clone https://github.com/deepmodeling/tutorials diff --git a/history/2024-11-14_changes.md b/history/2024-11-14_changes.md new file mode 100644 index 0000000..96749f0 --- /dev/null +++ b/history/2024-11-14_changes.md @@ -0,0 +1,12 @@ +## 📈 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 (🥈16 · ⭐ 24 · 📈) - APEX: Alloy Properties EXplorer using simulations. 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._ + +- DeePTB (🥈15 · ⭐ 54 · 📉) - DeePTB: A deep learning package for tight-binding approach with ab initio accuracy. LGPL-3.0 + diff --git a/history/2024-11-14_projects.csv b/history/2024-11-14_projects.csv new file mode 100644 index 0000000..bb405e4 --- /dev/null +++ b/history/2024-11-14_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 15:23:44,2024-11-14 18:10:17.000000,2024-09-17 18:00:40,2534,1.0,494.0,47.0,2170.0,68.0,747.0,1499.0,2024-07-03 19:22:15,2.2.11,42845.0,37191.0,50.0,A deep learning package for many-body potential energy representation and molecular dynamics.,20.0,20.0,69.0,https://pypi.org/project/deepmd-kit,8402.0,https://anaconda.org/conda-forge/deepmd-kit,2024-11-03 06:25:04.992,1205500.0,https://www.npmjs.com/package/deepmd-kit,6.0,https://hub.docker.com/r/deepmodeling/deepmd-kit,2024-07-27 08:24:51.741318,1.0,2934.0,26,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 04:04:52,2024-11-14 16:01:37.000000,2024-11-14 15:18:40,6863,220.0,134.0,11.0,3372.0,145.0,1861.0,173.0,2024-11-04 03:04:11,3.8.2,,14334.0,59.0,An electronic structure package based on either plane wave basis or numerical atomic orbitals.,,,121.0,,,https://anaconda.org/conda-forge/abacus,2024-11-10 06:22:03.031,229344.0,,,,,,,26,True,others,1.0, +2,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 13:24:23,2024-11-13 03:12:08.000000,2024-09-20 18:23:06,761,24.0,126.0,9.0,521.0,21.0,83.0,201.0,2024-09-20 18:24:21,0.2.21,,76945.0,37.0,A Python package for manipulating atomistic data of software in computational science.,129.0,129.0,61.0,https://pypi.org/project/dpdata,75339.0,https://anaconda.org/conda-forge/dpdata,2024-09-21 05:04:04.171,81479.0,,,https://hub.docker.com/r/dptechnology/dpdata,2023-06-02 09:30:14.674068,,638.0,25,True,others,1.0, +3,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 05:14:37,2024-11-11 22:19:29.000000,2024-10-28 19:13:50,1097,15.0,54.0,6.0,400.0,16.0,63.0,45.0,2024-08-30 18:52:29,0.6.7,,8486.0,47.0,generate HPC scheduler systems jobs input scripts and submit these scripts to HPC systems and poke until they finish.,53.0,53.0,47.0,https://pypi.org/project/dpdispatcher,5482.0,https://anaconda.org/conda-forge/dpdispatcher,2024-08-31 12:30:44.164,16756.0,,,https://hub.docker.com/r/dptechnology/dpdispatcher,2024-08-30 18:56:38.463169,,110923.0,24,True,others,1.0, +4,DP-GEN,deepmodeling/dpgen,dpgen,conda-forge/dpgen,,,https://github.com/deepmodeling/dpgen,https://github.com/deepmodeling/dpgen,LGPL-3.0,2019-06-13 11:43:56,2024-11-11 22:19:34.000000,2024-11-04 01:14:45,2084,1.0,169.0,13.0,854.0,35.0,266.0,307.0,2024-04-10 06:37:07,0.12.1,1816.0,1956.0,18.0,The deep potential generator to generate a deep-learning based model of interatomic potential energy and force field.,7.0,7.0,65.0,https://pypi.org/project/dpgen,1291.0,https://anaconda.org/conda-forge/dpgen,2024-04-10 09:44:30.012,33660.0,,,,,,,21,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 15:07:56,2024-11-13 17:53:39.000000,2024-11-12 23:09:06,2502,15.0,39.0,9.0,2154.0,5.0,120.0,67.0,2024-10-03 19:33:36,1.6.14,,14093.0,100.0,an automatic reaction network generator for reactive molecular dynamics simulation.,3.0,3.0,18.0,https://pypi.org/project/reacnetgenerator,5838.0,https://anaconda.org/conda-forge/reacnetgenerator,2024-10-04 04:12:50.002,445806.0,,,,,,,21,True,others,2.0, +6,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 08:14:36,2024-10-31 08:47:03.792786,2024-10-31 08:44:49,2130,62.0,26.0,1.0,843.0,14.0,21.0,65.0,2024-10-31 08:45:26,1.8.99,,272.0,100.0,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,2024-10-31 08:47:03.792786,,9280.0,19,True,others,2.0, +7,dargs,deepmodeling/dargs,dargs,conda-forge/dargs,,,https://github.com/deepmodeling/dargs,https://github.com/deepmodeling/dargs,LGPL-3.0,2020-09-19 22:20:28,2024-11-11 22:19:32.000000,2024-10-28 19:14:03,153,2.0,3.0,7.0,71.0,3.0,6.0,5.0,2024-07-15 00:16:52,0.4.8,,100119.0,29.0,Argument processing for the deep modeling project.,129.0,129.0,7.0,https://pypi.org/project/dargs,99338.0,https://anaconda.org/conda-forge/dargs,2024-07-15 04:32:31.846,33586.0,,,,,,,18,True,others,2.0, +8,DeepFlame,deepmodeling/deepflame-dev,,,,,https://github.com/deepmodeling/deepflame-dev,https://github.com/deepmodeling/deepflame-dev,GPL-3.0,2022-06-12 10:25:12,2024-11-11 07:08:37.000000,2024-11-03 08:29:00,1116,51.0,61.0,6.0,476.0,20.0,29.0,138.0,2024-08-23 01:31:45,1.4,,,20.0,A deep learning empowered open-source platform for reacting flow simulations.,,,24.0,,,,,,,,,,,,17,True,others,2.0, +9,DPGEN2,deepmodeling/dpgen2,dpgen2,,,dptechnology/dpgen2,https://github.com/deepmodeling/dpgen2,https://github.com/deepmodeling/dpgen2,LGPL-3.0,2022-02-28 02:41:16,2024-10-29 04:22:10.046736,2024-10-29 03:39:33,324,19.0,26.0,7.0,233.0,10.0,23.0,33.0,2023-01-28 03:43:25,0.0.7,,616.0,7.0,2nd generation of the Deep Potential GENerator.,5.0,5.0,14.0,https://pypi.org/project/dpgen2,507.0,,,,,,https://hub.docker.com/r/dptechnology/dpgen2,2024-10-29 04:22:10.046736,,3609.0,17,True,others,2.0, +10,APEX,deepmodeling/APEX,apex-flow,,,,https://github.com/deepmodeling/APEX,https://github.com/deepmodeling/APEX,LGPL-3.0,2023-04-20 06:13:42,2024-10-25 03:40:57.000000,2024-10-25 03:40:57,591,14.0,16.0,7.0,77.0,,8.0,24.0,2024-05-06 10:01:52,1.2.0,,5599.0,4.0,APEX: Alloy Properties EXplorer using simulations.,3.0,3.0,6.0,https://pypi.org/project/apex-flow,5599.0,,,,,,,,,,16,True,others,2.0,1.0 +11,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 15:20:54,2024-10-30 02:47:21.000000,2024-10-30 02:47:14,205,15.0,44.0,14.0,5.0,23.0,14.0,287.0,,,,567.0,,Differentiable Finite Element Method with JAX.,3.0,3.0,8.0,https://pypi.org/project/jax-fem,567.0,,,,,,,,,,15,True,others,2.0, +12,DeePTB,deepmodeling/DeePTB,dptb,,,,https://github.com/deepmodeling/DeePTB,https://github.com/deepmodeling/DeePTB,LGPL-3.0,2023-07-11 03:19:42,2024-10-03 18:52:57.000000,2024-10-03 18:52:57,748,4.0,16.0,3.0,177.0,10.0,28.0,54.0,2024-08-15 03:02:38,2.1.1,,485.0,11.0,DeePTB: A deep learning package for tight-binding approach with ab initio accuracy.,2.0,2.0,10.0,https://pypi.org/project/dptb,485.0,,,,,,,,,,15,True,others,2.0,-1.0 +13,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,,42.0,9.0,164.0,10.0,16.0,154.0,2023-11-09 14:32:37,1.0.0,,115.0,4.0,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 07:33:02.470,1154.0,,,,,,,14,True,others,2.0, +14,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,,22.0,5.0,21.0,1.0,3.0,44.0,2024-05-14 03:25:35,0.6.4,145.0,439.0,5.0,Reinforced dynamics.,2.0,2.0,14.0,https://pypi.org/project/rid-kit,436.0,,,,,,,,,,13,True,others,2.0, +15,DP-GUI,deepmodeling/dpgui,dpgui,,,,https://github.com/deepmodeling/dpgui,https://github.com/deepmodeling/dpgui,LGPL-3.0,2021-07-21 18:48:23,2024-11-11 22:19:37.000000,2024-09-11 04:21:44,306,2.0,5.0,6.0,475.0,,1.0,7.0,2023-10-13 05:16:09,1.0.0,,49251.0,4.0,A web-based GUI for user inputs.,9.0,9.0,4.0,https://pypi.org/project/dpgui,49251.0,,,,,,,,,,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 00:19:06,2024-11-11 22:19:21.000000,2024-10-27 22:37:03,76,5.0,7.0,5.0,68.0,,,3.0,2024-10-27 22:37:32,0.3.0,,4715.0,24.0,Sphinx extension for DeepModeling projects.,,,7.0,https://pypi.org/project/deepmodeling_sphinx,4715.0,,,,,,,,,,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 05:40:21,2024-10-30 21:19:01.000000,2024-10-30 21:16:48,4195,234.0,,,,,,3.0,,,,,,Graphics Processing Units Molecular Dynamics.,,,37.0,,,,,,,,,,,,11,True,others,3.0, +18,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,,36.0,14.0,46.0,7.0,14.0,102.0,,,,,,a package for developing machine learning-based chemically accurate energy and density functional models.,,,7.0,,,,,,,,,,,,10,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 13:57:37,2024-11-11 22:19:41.000000,2024-11-11 16:07:41,410,4.0,19.0,7.0,73.0,8.0,1.0,22.0,,,,213.0,,A Python Package to Automate Thermodynamic Integration Calculations for Free Energy.,2.0,2.0,19.0,https://pypi.org/project/dpti,213.0,,,,,,,,,,10,True,others,3.0, +20,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,,12.0,9.0,25.0,4.0,,2.0,,,,1745.0,,,11.0,11.0,4.0,https://pypi.org/project/fpop,1745.0,,,,,,,,,,9,True,others,3.0, +21,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 09:19:17,137,12.0,21.0,11.0,42.0,,2.0,83.0,,,,,,DeepModeling community content.,,,17.0,,,,,,,,,,,,8,True,others,3.0, +22,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,,,3.0,,,,326.0,,Finite Element Analysis Library in Python.,,,57.0,https://pypi.org/project/fealpy,326.0,,,,,,,,,,8,True,others,3.0, +23,args,deepmodeling/args,,,@deepmodeling/args,,https://github.com/deepmodeling/args,https://github.com/deepmodeling/args,LGPL-3.0,2021-12-27 03:27:24,2024-09-02 15:27:53.000000,2024-09-02 15:27:51,74,1.0,2.0,6.0,47.0,,,2.0,2024-04-11 23:49:50,0.0.17,,61.0,16.0,DeepModeling dargs arguments generation.,5.0,5.0,3.0,,,,,,https://www.npmjs.com/package/@deepmodeling/args,61.0,,,,,8,True,others,3.0, +24,Blog,deepmodeling/blog,,,,,https://github.com/deepmodeling/blog,https://github.com/deepmodeling/blog,LGPL-3.0,2021-06-10 23:11:55,2024-11-14 01:50:38.000000,2024-11-14 01:50:38,188,18.0,8.0,6.0,121.0,,,1.0,,,,,,DeepModeling Blog.,,,8.0,,,,,,,,,,,,8,True,others,3.0, +25,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,,1.0,91.0,,,,22.0,,,,,3.0,,,,,,,,https://hub.docker.com/r/dptechnology/unifold,2024-01-08 06:24:09.367953,,778.0,7,True,others,3.0, +26,AIS-Square,deepmodeling/AIS-Square,,,,,https://github.com/deepmodeling/AIS-Square,https://github.com/deepmodeling/AIS-Square,LGPL-3.0,2022-09-13 09:52:30,2024-11-13 18:03:45.000000,2023-12-06 03:06:55,469,,8.0,8.0,210.0,5.0,1.0,12.0,,,,,,,,,8.0,,,,,,,,,,,,6,True,others,3.0, +27,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,,8.0,2024-03-01 09:33:35,1.6,,,1.0,Repository of TBPLaS (tight-binding package for large-scale simulation).,,,10.0,,,,,,,,,,,,6,True,others,3.0, +28,DeePDih,deepmodeling/DeePDih,,,,,https://github.com/deepmodeling/DeePDih,https://github.com/deepmodeling/DeePDih,MIT,2024-03-03 13:22:19,2024-06-23 14:34:36.000000,2024-04-19 07:37:47,61,,3.0,2.0,,,,4.0,,,,,,Deep Potential driven molecular dihedral scan toolkit.,,,,,,,,,,,,,,,6,True,others,3.0, +29,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,,,,,,,,,,,,6,True,others,3.0, +30,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,,13.0,9.0,29.0,,1.0,84.0,,,,,,AI for Science.,,,5.0,,,,,,,,,,,,5,True,others,3.0, +31,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 19:01:44,143,1.0,23.0,5.0,67.0,1.0,2.0,14.0,,,,,,Tutorials for DeepModeling projects.,,,10.0,,,,,,,,,,,,4,True,others,3.0, +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,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, +34,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,,2.0,1.0,6.0,,,2.0,,,,,,Automatic Differentiation Multipole Moment Molecular Forcefield.,,,7.0,,,,,,,,,,,,2,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 896a6ef..96749f0 100644 --- a/latest-changes.md +++ b/latest-changes.md @@ -2,16 +2,11 @@ _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._ -- dargs (🥈18 · ⭐ 5 · 📈) - Argument processing for the deep modeling project. LGPL-3.0 -- Blog (🥉8 · ⭐ 1 · 📈) - DeepModeling Blog. LGPL-3.0 +- APEX (🥈16 · ⭐ 24 · 📈) - APEX: Alloy Properties EXplorer using simulations. 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._ -- DP-GEN (🥈21 · ⭐ 310 · 📉) - The deep potential generator to generate a deep-learning based model of interatomic potential energy and force field. LGPL-3.0 -- APEX (🥈15 · ⭐ 23 · 📉) - APEX: Alloy Properties EXplorer using simulations. LGPL-3.0 -- rid-kit (🥈13 · ⭐ 44 · 📉) - Reinforced dynamics. LGPL-3.0 -- dpti (🥉10 · ⭐ 22 · 📉) - A Python Package to Automate Thermodynamic Integration Calculations for Free Energy. LGPL-3.0 -- tutorials (🥉4 · ⭐ 13 · 📉) - Tutorials for DeepModeling projects. Unlicensed +- DeePTB (🥈15 · ⭐ 54 · 📉) - DeePTB: A deep learning package for tight-binding approach with ab initio accuracy. LGPL-3.0