diff --git a/README.md b/README.md index 868ef7b..9953cca 100644 --- a/README.md +++ b/README.md @@ -46,20 +46,20 @@ This curated list contains 38 awesome open-source projects with a total of 3.3K
DeePMD-kit (🥇28 · ⭐ 1.4K) - A deep learning package for many-body potential energy representation and molecular dynamics. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/deepmd-kit) (👨‍💻 69 · 🔀 480 · 📥 38K · 📦 16 · 📋 750 - 10% open · ⏱️ 06.07.2024): +- [GitHub](https://github.com/deepmodeling/deepmd-kit) (👨‍💻 69 · 🔀 480 · 📥 39K · 📦 16 · 📋 750 - 10% open · ⏱️ 06.07.2024): ``` git clone https://github.com/deepmodeling/deepmd-kit ``` -- [PyPi](https://pypi.org/project/deepmd-kit) (📥 1.4K / month): +- [PyPi](https://pypi.org/project/deepmd-kit) (📥 1.5K / month): ``` pip install deepmd-kit ``` -- [Conda](https://anaconda.org/conda-forge/deepmd-kit) (📥 860K · ⏱️ 27.07.2024): +- [Conda](https://anaconda.org/conda-forge/deepmd-kit) (📥 890K · ⏱️ 27.07.2024): ``` conda install -c conda-forge deepmd-kit ``` -- [npm](https://www.npmjs.com/package/deepmd-kit) (📥 17 / month): +- [npm](https://www.npmjs.com/package/deepmd-kit) (📥 15 / month): ``` npm install deepmd-kit ``` @@ -68,19 +68,19 @@ This curated list contains 38 awesome open-source projects with a total of 3.3K docker pull deepmodeling/deepmd-kit ```
-
ABACUS (🥇26 · ⭐ 150 · 📈) - An electronic structure package based on either plane wave basis or numerical atomic orbitals. LGPL-3.0 +
ABACUS (🥇26 · ⭐ 160) - 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 · 📋 1.8K - 11% open · ⏱️ 15.08.2024): +- [GitHub](https://github.com/deepmodeling/abacus-develop) (👨‍💻 120 · 🔀 130 · 📋 1.8K - 10% open · ⏱️ 21.08.2024): ``` git clone https://github.com/deepmodeling/abacus-develop ``` -- [Conda](https://anaconda.org/conda-forge/abacus) (📥 110K · ⏱️ 13.08.2024): +- [Conda](https://anaconda.org/conda-forge/abacus) (📥 120K · ⏱️ 13.08.2024): ``` conda install -c conda-forge abacus ```
-
dpdata (🥇23 · ⭐ 200 · 📉) - Manipulating multiple atomic simulation data formats, including DeePMD-kit, VASP, LAMMPS, ABACUS, etc. LGPL-3.0 +
dpdata (🥇23 · ⭐ 200) - Manipulating multiple atomic simulation data formats, including DeePMD-kit, VASP, LAMMPS, ABACUS, etc. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/dpdata) (👨‍💻 60 · 🔀 120 · 📦 120 · 📋 96 - 16% open · ⏱️ 06.06.2024): @@ -107,7 +107,7 @@ This curated list contains 38 awesome open-source projects with a total of 3.3K ``` git clone https://github.com/deepmodeling/dpgen ``` -- [PyPi](https://pypi.org/project/dpgen) (📥 320 / month): +- [PyPi](https://pypi.org/project/dpgen) (📥 390 / month): ``` pip install dpgen ``` @@ -118,12 +118,12 @@ This curated list contains 38 awesome open-source projects with a total of 3.3K
dpdispatcher (🥇22 · ⭐ 42) - 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 · 🔀 53 · 📦 50 · 📋 75 - 20% open · ⏱️ 03.08.2024): +- [GitHub](https://github.com/deepmodeling/dpdispatcher) (👨‍💻 46 · 🔀 53 · 📦 50 · 📋 75 - 20% open · ⏱️ 20.08.2024): ``` git clone https://github.com/deepmodeling/dpdispatcher ``` -- [PyPi](https://pypi.org/project/dpdispatcher) (📥 2.2K / month): +- [PyPi](https://pypi.org/project/dpdispatcher) (📥 2.4K / month): ``` pip install dpdispatcher ``` @@ -136,23 +136,23 @@ This curated list contains 38 awesome open-source projects with a total of 3.3K docker pull dptechnology/dpdispatcher ```
-
reacnetgenerator (🥈19 · ⭐ 63 · 📉) - an automatic reaction network generator for reactive molecular dynamics simulation. LGPL-3.0 +
reacnetgenerator (🥈19 · ⭐ 63) - an automatic reaction network generator for reactive molecular dynamics simulation. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/reacnetgenerator) (👨‍💻 18 · 🔀 35 · 📦 2 · 📋 120 - 3% open · ⏱️ 09.08.2024): ``` git clone https://github.com/deepmodeling/reacnetgenerator ``` -- [PyPi](https://pypi.org/project/reacnetgenerator) (📥 430 / month): +- [PyPi](https://pypi.org/project/reacnetgenerator) (📥 760 / month): ``` pip install reacnetgenerator ``` -- [Conda](https://anaconda.org/conda-forge/reacnetgenerator) (📥 360K · ⏱️ 10.05.2024): +- [Conda](https://anaconda.org/conda-forge/reacnetgenerator) (📥 370K · ⏱️ 10.05.2024): ``` conda install -c conda-forge reacnetgenerator ```
-
dflow (🥈19 · ⭐ 60) - Dflow is a Python framework for constructing scientific computing workflows (e.g. concurrent learning workflows).. LGPL-3.0 +
dflow (🥈19 · ⭐ 61) - 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 · 🔀 25 · 📋 35 - 40% open · ⏱️ 07.08.2024): @@ -172,7 +172,7 @@ This curated list contains 38 awesome open-source projects with a total of 3.3K docker pull dptechnology/dflow ```
-
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 · 📦 120 · 📋 8 - 25% open · ⏱️ 17.07.2024): @@ -183,45 +183,57 @@ This curated list contains 38 awesome open-source projects with a total of 3.3K ``` pip install dargs ``` -- [Conda](https://anaconda.org/conda-forge/dargs) (📥 28K · ⏱️ 15.07.2024): +- [Conda](https://anaconda.org/conda-forge/dargs) (📥 29K · ⏱️ 15.07.2024): ``` conda install -c conda-forge dargs ```
-
DPGEN2 (🥈17 · ⭐ 31) - 2nd generation of the Deep Potential GENerator. LGPL-3.0 +
DeepFlame (🥈18 · ⭐ 130 · 📈) - A deep learning empowered open-source platform for reacting flow simulations. GPL-3.0 -- [GitHub](https://github.com/deepmodeling/dpgen2) (👨‍💻 14 · 🔀 24 · 📦 4 · 📋 32 - 28% open · ⏱️ 13.08.2024): +- [GitHub](https://github.com/deepmodeling/deepflame-dev) (👨‍💻 24 · 🔀 58 · 📋 46 - 36% open · ⏱️ 22.08.2024): ``` - git clone https://github.com/deepmodeling/dpgen2 + git clone https://github.com/deepmodeling/deepflame-dev ``` -- [PyPi](https://pypi.org/project/dpgen2) (📥 55 / month): +
+
DeePTB (🥈17 · ⭐ 44 · 📈) - DeePTB: A deep learning package for tight-binding approach with ab initio accuracy. LGPL-3.0 + +- [GitHub](https://github.com/deepmodeling/DeePTB) (👨‍💻 9 · 🔀 14 · 📦 1 · 📋 34 - 20% open · ⏱️ 21.08.2024): + ``` - pip install dpgen2 + git clone https://github.com/deepmodeling/DeePTB ``` -- [Docker Hub](https://hub.docker.com/r/dptechnology/dpgen2) (📥 3.4K · ⏱️ 13.08.2024): +- [PyPi](https://pypi.org/project/dptb) (📥 240 / month): ``` - docker pull dptechnology/dpgen2 + pip install dptb ```
-
DeepFlame (🥈16 · ⭐ 130) - A deep learning empowered open-source platform for reacting flow simulations. GPL-3.0 +
DPGEN2 (🥈17 · ⭐ 31) - 2nd generation of the Deep Potential GENerator. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/deepflame-dev) (👨‍💻 24 · 🔀 58 · 📋 46 - 36% open · ⏱️ 05.08.2024): +- [GitHub](https://github.com/deepmodeling/dpgen2) (👨‍💻 14 · 🔀 24 · 📦 4 · 📋 32 - 28% open · ⏱️ 22.08.2024): ``` - git clone https://github.com/deepmodeling/deepflame-dev + git clone https://github.com/deepmodeling/dpgen2 + ``` +- [PyPi](https://pypi.org/project/dpgen2) (📥 73 / month): + ``` + pip install dpgen2 + ``` +- [Docker Hub](https://hub.docker.com/r/dptechnology/dpgen2) (📥 3.5K · ⏱️ 22.08.2024): + ``` + docker pull dptechnology/dpgen2 ```
-
DeePTB (🥈16 · ⭐ 40 · 📈) - DeePTB: A deep learning package for tight-binding approach with ab initio accuracy. LGPL-3.0 +
JAX-FEM (🥈13 · ⭐ 220 · 📈) - Differentiable Finite Element Method with JAX. GPL-3.0 -- [GitHub](https://github.com/deepmodeling/DeePTB) (👨‍💻 9 · 🔀 14 · 📦 1 · 📋 34 - 20% open · ⏱️ 15.08.2024): +- [GitHub](https://github.com/deepmodeling/jax-fem) (👨‍💻 7 · 🔀 33 · 📦 1 · 📋 25 - 72% open · ⏱️ 19.08.2024): ``` - git clone https://github.com/deepmodeling/DeePTB + git clone https://github.com/deepmodeling/jax-fem ``` -- [PyPi](https://pypi.org/project/dptb) (📥 140 / month): +- [PyPi](https://pypi.org/project/jax-fem) (📥 200 / month): ``` - pip install dptb + pip install jax-fem ```
DMFF (🥈13 · ⭐ 150 · 💤) - DMFF (Differentiable Molecular Force Field) is a Jax-based python package that provides a full differentiable.. LGPL-3.0 @@ -231,19 +243,19 @@ This curated list contains 38 awesome open-source projects with a total of 3.3K ``` git clone https://github.com/deepmodeling/DMFF ``` -- [Conda](https://anaconda.org/conda-forge/dmff) (📥 670 · ⏱️ 06.01.2024): +- [Conda](https://anaconda.org/conda-forge/dmff) (📥 700 · ⏱️ 06.01.2024): ``` conda install -c conda-forge dmff ```
-
rid-kit (🥈13 · ⭐ 42 · 📉) - Reinforced dynamics. LGPL-3.0 +
rid-kit (🥈13 · ⭐ 42) - Reinforced dynamics. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/rid-kit) (👨‍💻 14 · 🔀 21 · 📥 140 · 📦 1 · 📋 4 - 25% open · ⏱️ 27.06.2024): ``` git clone https://github.com/deepmodeling/rid-kit ``` -- [PyPi](https://pypi.org/project/rid-kit) (📥 52 / month): +- [PyPi](https://pypi.org/project/rid-kit) (📥 81 / month): ``` pip install rid-kit ``` @@ -267,7 +279,7 @@ This curated list contains 38 awesome open-source projects with a total of 3.3K ``` git clone https://github.com/deepmodeling/dpgui ``` -- [PyPi](https://pypi.org/project/dpgui) (📥 14K / month): +- [PyPi](https://pypi.org/project/dpgui) (📥 16K / month): ``` pip install dpgui ``` @@ -279,26 +291,14 @@ This curated list contains 38 awesome open-source projects with a total of 3.3K ``` git clone https://github.com/deepmodeling/deepmodeling_sphinx ``` -- [PyPi](https://pypi.org/project/deepmodeling_sphinx) (📥 2.7K / month): +- [PyPi](https://pypi.org/project/deepmodeling_sphinx) (📥 2.4K / month): ``` pip install deepmodeling_sphinx ```
-
JAX-FEM (🥉11 · ⭐ 210 · 📉) - Differentiable Finite Element Method with JAX. GPL-3.0 - -- [GitHub](https://github.com/deepmodeling/jax-fem) (👨‍💻 7 · 🔀 33 · 📦 1 · 📋 25 - 72% open · ⏱️ 24.07.2024): - - ``` - git clone https://github.com/deepmodeling/jax-fem - ``` -- [PyPi](https://pypi.org/project/jax-fem) (📥 130 / month): - ``` - pip install jax-fem - ``` -
GPUMD (🥉11 · ⭐ 3 · 🐣) - Graphics Processing Units Molecular Dynamics. GPL-3.0 -- [GitHub](https://github.com/deepmodeling/GPUMD) (👨‍💻 30 · ⏱️ 15.08.2024): +- [GitHub](https://github.com/deepmodeling/GPUMD) (👨‍💻 33 · ⏱️ 21.08.2024): ``` git clone https://github.com/deepmodeling/GPUMD @@ -312,14 +312,14 @@ This curated list contains 38 awesome open-source projects with a total of 3.3K git clone https://github.com/deepmodeling/deepks-kit ```
-
dpti (🥉10 · ⭐ 19 · 📈) - A Python Package to Automate Thermodynamic Integration Calculations for Free Energy. LGPL-3.0 +
dpti (🥉10 · ⭐ 19) - A Python Package to Automate Thermodynamic Integration Calculations for Free Energy. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/dpti) (👨‍💻 19 · 🔀 20 · 📦 1 · ⏱️ 14.08.2024): ``` git clone https://github.com/deepmodeling/dpti ``` -- [PyPi](https://pypi.org/project/dpti) (📥 43 / month): +- [PyPi](https://pypi.org/project/dpti) (📥 66 / month): ``` pip install dpti ``` @@ -331,26 +331,38 @@ This curated list contains 38 awesome open-source projects with a total of 3.3K ``` git clone https://github.com/deepmodeling/args ``` -- [npm](https://www.npmjs.com/package/@deepmodeling/args) (📥 140 / month): +- [npm](https://www.npmjs.com/package/@deepmodeling/args) (📥 120 / month): ``` npm install @deepmodeling/args ```
-
fpop (🥉8 · ⭐ 2) - LGPL-3.0 +
fpop (🥉9 · ⭐ 2 · 📈) - LGPL-3.0 - [GitHub](https://github.com/deepmodeling/fpop) (👨‍💻 4 · 🔀 11 · 📦 8 · ⏱️ 01.07.2024): ``` git clone https://github.com/deepmodeling/fpop ``` -- [PyPi](https://pypi.org/project/fpop) (📥 810 / month): +- [PyPi](https://pypi.org/project/fpop) (📥 1.3K / month): ``` pip install fpop ```
+
Uni-Fold (🥉7 · ⭐ 91 · 💤) - Apache-2 + +- [GitHub](https://github.com/deepmodeling/Uni-Fold) (👨‍💻 3 · 🔀 18 · ⏱️ 18.08.2022): + + ``` + git clone https://github.com/deepmodeling/Uni-Fold + ``` +- [Docker Hub](https://hub.docker.com/r/dptechnology/unifold) (📥 680 · ⏱️ 08.01.2024): + ``` + docker pull dptechnology/unifold + ``` +
community (🥉7 · ⭐ 79) - DeepModeling community content. Unlicensed -- [GitHub](https://github.com/deepmodeling/community) (👨‍💻 17 · 🔀 20 · ⏱️ 12.07.2024): +- [GitHub](https://github.com/deepmodeling/community) (👨‍💻 17 · 🔀 20 · ⏱️ 21.08.2024): ``` git clone https://github.com/deepmodeling/community @@ -371,7 +383,7 @@ This curated list contains 38 awesome open-source projects with a total of 3.3K ``` git clone https://github.com/deepmodeling/fealpy ``` -- [PyPi](https://pypi.org/project/fealpy) (📥 88 / month): +- [PyPi](https://pypi.org/project/fealpy) (📥 100 / month): ``` pip install fealpy ``` @@ -384,21 +396,9 @@ This curated list contains 38 awesome open-source projects with a total of 3.3K git clone https://github.com/deepmodeling/blog ```
-
Uni-Fold (🥉6 · ⭐ 91 · 💤) - Apache-2 - -- [GitHub](https://github.com/deepmodeling/Uni-Fold) (👨‍💻 3 · 🔀 18 · ⏱️ 18.08.2022): - - ``` - git clone https://github.com/deepmodeling/Uni-Fold - ``` -- [Docker Hub](https://hub.docker.com/r/dptechnology/unifold) (📥 670 · ⏱️ 08.01.2024): - ``` - docker pull dptechnology/unifold - ``` -
-
tutorials (🥉6 · ⭐ 13 · 💤) - Tutorials for DeepModeling projects. Unlicensed +
tutorials (🥉6 · ⭐ 13) - Tutorials for DeepModeling projects. Unlicensed -- [GitHub](https://github.com/deepmodeling/tutorials) (👨‍💻 10 · 🔀 22 · ⏱️ 26.09.2022): +- [GitHub](https://github.com/deepmodeling/tutorials) (👨‍💻 10 · 🔀 22 · ⏱️ 21.08.2024): ``` git clone https://github.com/deepmodeling/tutorials diff --git a/history/2024-08-22_changes.md b/history/2024-08-22_changes.md new file mode 100644 index 0000000..5aef4bd --- /dev/null +++ b/history/2024-08-22_changes.md @@ -0,0 +1,10 @@ +## 📈 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._ + +- DeepFlame (🥈18 · ⭐ 130 · 📈) - A deep learning empowered open-source platform for reacting flow simulations. GPL-3.0 +- DeePTB (🥈17 · ⭐ 44 · 📈) - DeePTB: A deep learning package for tight-binding approach with ab initio accuracy. LGPL-3.0 +- JAX-FEM (🥈13 · ⭐ 220 · 📈) - Differentiable Finite Element Method with JAX. GPL-3.0 +- fpop (🥉9 · ⭐ 2 · 📈) - LGPL-3.0 +- Uni-Fold (🥉7 · ⭐ 91 · 💤) - Apache-2 + diff --git a/history/2024-08-22_projects.csv b/history/2024-08-22_projects.csv new file mode 100644 index 0000000..c63e263 --- /dev/null +++ b/history/2024-08-22_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 15:23:44,2024-08-22 08:54:26.000000,2024-07-06 15:29:41,2533,32.0,477.0,47.0,1994.0,78.0,671.0,1432.0,2024-07-03 19:22:15,2.2.11,38539.0,24420.0,49.0,A deep learning package for many-body potential energy representation and molecular dynamics.,16.0,16.0,69.0,https://pypi.org/project/deepmd-kit,1487.0,https://anaconda.org/conda-forge/deepmd-kit,2024-07-27 05:59:01.371,888383.0,https://www.npmjs.com/package/deepmd-kit,15.0,https://hub.docker.com/r/deepmodeling/deepmd-kit,2024-07-27 08:24:51.741318,1.0,2716.0,28,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 04:04:52,2024-08-21 08:11:47.000000,2024-08-21 03:55:09,6645,372.0,127.0,11.0,3113.0,190.0,1602.0,159.0,2024-08-12 07:52:22,3.7.3,,9411.0,54.0,An electronic structure package based on either plane wave basis or numerical atomic orbitals.,,,119.0,,,https://anaconda.org/conda-forge/abacus,2024-08-13 02:51:33.714,122345.0,,,,,,,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 13:24:23,2024-08-20 06:15:51.000000,2024-06-06 00:03:38,724,5.0,122.0,9.0,478.0,16.0,80.0,195.0,2024-06-06 00:06:28,0.2.19,,32090.0,35.0,"Manipulating multiple atomic simulation data formats, including DeePMD-kit, VASP, LAMMPS, ABACUS, etc.",122.0,122.0,60.0,https://pypi.org/project/dpdata,30537.0,https://anaconda.org/conda-forge/dpdata,2024-06-06 04:58:08.772,74128.0,,,https://hub.docker.com/r/dptechnology/dpdata,2023-06-02 09:30:14.674068,,628.0,23,True,others,1.0, +3,DP-GEN,deepmodeling/dpgen,dpgen,conda-forge/dpgen,,,https://github.com/deepmodeling/dpgen,https://github.com/deepmodeling/dpgen,LGPL-3.0,2019-06-13 11:43:56,2024-08-20 06:20:33.000000,2024-04-10 06:31:36,2083,,167.0,13.0,836.0,31.0,262.0,291.0,2024-04-10 06:37:07,0.12.1,1745.0,1032.0,18.0,The deep potential generator to generate a deep-learning based model of interatomic potential energy and force field.,6.0,6.0,64.0,https://pypi.org/project/dpgen,386.0,https://anaconda.org/conda-forge/dpgen,2024-04-10 09:44:30.012,30822.0,,,,,,,22,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 05:14:37,2024-08-20 22:24:19.000000,2024-08-20 22:24:19,1087,23.0,53.0,6.0,384.0,15.0,60.0,42.0,2024-07-25 20:09:38,0.6.6,,5283.0,46.0,generate HPC scheduler systems jobs input scripts and submit these scripts to HPC systems and poke until they finish.,50.0,50.0,46.0,https://pypi.org/project/dpdispatcher,2394.0,https://anaconda.org/conda-forge/dpdispatcher,2024-07-26 02:15:35.159,12084.0,,,https://hub.docker.com/r/dptechnology/dpdispatcher,2024-07-25 20:13:29.078525,,104057.0,22,True,others,1.0, +5,reacnetgenerator,deepmodeling/reacnetgenerator,reacnetgenerator,conda-forge/reacnetgenerator,,,https://github.com/deepmodeling/reacnetgenerator,https://github.com/deepmodeling/reacnetgenerator,LGPL-3.0,2018-04-06 15:07:56,2024-08-19 21:53:38.000000,2024-08-09 21:15:53,2487,12.0,35.0,9.0,2119.0,4.0,120.0,63.0,2024-05-09 23:35:17,1.6.13,,7982.0,100.0,an automatic reaction network generator for reactive molecular dynamics simulation.,2.0,2.0,18.0,https://pypi.org/project/reacnetgenerator,759.0,https://anaconda.org/conda-forge/reacnetgenerator,2024-05-10 07:03:30.570,368400.0,,,,,,,19,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 08:14:36,2024-08-07 02:33:46.000000,2024-08-07 02:32:52,2068,78.0,25.0,1.0,813.0,14.0,21.0,61.0,2024-08-06 02:55:43,1.8.85,,246.0,100.0,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,2024-08-06 02:57:15.823479,,7630.0,19,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 22:20:28,2024-08-19 21:53:17.000000,2024-07-17 20:31:43,151,13.0,3.0,7.0,69.0,2.0,6.0,5.0,2024-07-15 00:16:52,0.4.8,,53179.0,29.0,Argument processing for the deep modeling project.,122.0,122.0,7.0,https://pypi.org/project/dargs,52459.0,https://anaconda.org/conda-forge/dargs,2024-07-15 04:32:31.846,28828.0,,,,,,,19,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 10:25:12,2024-08-22 14:03:45.000000,2024-08-22 14:03:45,1101,46.0,58.0,6.0,464.0,17.0,29.0,131.0,2024-03-02 04:46:26,1.3.1,,,19.0,A deep learning empowered open-source platform for reacting flow simulations.,,,24.0,,,,,,,,,,,,18,True,others,2.0,2.0 +9,DeePTB,deepmodeling/DeePTB,dptb,,,,https://github.com/deepmodeling/DeePTB,https://github.com/deepmodeling/DeePTB,LGPL-3.0,2023-07-11 03:19:42,2024-08-21 13:55:36.000000,2024-08-21 13:55:35,745,52.0,14.0,3.0,169.0,7.0,27.0,44.0,2024-08-15 03:02:38,2.1.1,,244.0,11.0,DeePTB: A deep learning package for tight-binding approach with ab initio accuracy.,1.0,1.0,9.0,https://pypi.org/project/dptb,244.0,,,,,,,,,,17,True,others,2.0,1.0 +10,DPGEN2,deepmodeling/dpgen2,dpgen2,,,dptechnology/dpgen2,https://github.com/deepmodeling/dpgen2,https://github.com/deepmodeling/dpgen2,LGPL-3.0,2022-02-28 02:41:16,2024-08-22 12:51:04.969490,2024-08-22 12:49:34,309,30.0,24.0,7.0,218.0,9.0,23.0,31.0,2023-01-28 03:43:25,0.0.7,,188.0,7.0,2nd generation of the Deep Potential GENerator.,4.0,4.0,14.0,https://pypi.org/project/dpgen2,73.0,,,,,,https://hub.docker.com/r/dptechnology/dpgen2,2024-08-22 12:51:04.969490,,3468.0,17,True,others,2.0, +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 15:20:54,2024-08-19 08:24:48.000000,2024-08-19 08:24:45,193,5.0,33.0,11.0,4.0,18.0,7.0,217.0,,,,202.0,,Differentiable Finite Element Method with JAX.,1.0,1.0,7.0,https://pypi.org/project/jax-fem,202.0,,,,,,,,,,13,True,others,2.0,2.0 +12,DMFF,deepmodeling/DMFF,,conda-forge/dmff,,,https://github.com/deepmodeling/DMFF,https://github.com/deepmodeling/DMFF,LGPL-3.0,2022-02-14 01:35:50,2024-08-20 02:36:26.000000,2024-01-12 00:58:20,431,,40.0,9.0,159.0,10.0,16.0,146.0,2023-11-09 14:32:37,1.0.0,,99.0,4.0,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 07:33:02.470,696.0,,,,,,,13,True,others,2.0, +13,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 07:19:24,475,2.0,21.0,5.0,21.0,1.0,3.0,42.0,2024-05-14 03:25:35,0.6.4,144.0,85.0,5.0,Reinforced dynamics.,1.0,1.0,14.0,https://pypi.org/project/rid-kit,81.0,,,,,,,,,,13,True,others,2.0, +14,APEX,deepmodeling/APEX,apex-flow,,,,https://github.com/deepmodeling/APEX,https://github.com/deepmodeling/APEX,LGPL-3.0,2023-04-20 06:13:42,2024-08-08 01:57:28.000000,2024-05-06 09:59:20,529,,16.0,7.0,70.0,,6.0,20.0,2024-05-06 10:01:52,1.2.0,,450.0,4.0,APEX: Alloy Properties EXplorer using simulations.,1.0,1.0,6.0,https://pypi.org/project/apex-flow,450.0,,,,,,,,,,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 18:48:23,2024-08-19 21:53:16.000000,2024-05-31 07:44:25,304,2.0,4.0,6.0,473.0,,1.0,7.0,2023-10-13 05:16:09,1.0.0,,15613.0,4.0,A web-based GUI for user inputs.,8.0,8.0,3.0,https://pypi.org/project/dpgui,15613.0,,,,,,,,,,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 00:19:06,2024-08-19 21:53:07.000000,2024-08-06 19:25:57,71,5.0,6.0,5.0,63.0,,,2.0,2024-07-18 07:27:48,0.2.9,,2356.0,22.0,Sphinx extension for DeepModeling projects.,,,7.0,https://pypi.org/project/deepmodeling_sphinx,2356.0,,,,,,,,,,12,True,others,3.0, +17,GPUMD,deepmodeling/GPUMD,,,,,https://github.com/deepmodeling/GPUMD,https://github.com/deepmodeling/GPUMD,GPL-3.0,2024-06-18 05:40:21,2024-08-22 06:05:51.000000,2024-08-21 16:30:32,3966,230.0,,,,,,3.0,,,,,,Graphics Processing Units Molecular Dynamics.,,,33.0,,,,,,,,,,,,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 03:27:50,2024-08-08 16:28:48.000000,2024-04-13 03:44:40,384,,35.0,14.0,44.0,5.0,14.0,96.0,,,,,,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 13:57:37,2024-08-19 21:53:16.000000,2024-08-14 03:08:53,406,12.0,20.0,7.0,70.0,7.0,,19.0,,,,66.0,,A Python Package to Automate Thermodynamic Integration Calculations for Free Energy.,1.0,1.0,19.0,https://pypi.org/project/dpti,66.0,,,,,,,,,,10,True,others,3.0, +20,args,deepmodeling/args,,,@deepmodeling/args,,https://github.com/deepmodeling/args,https://github.com/deepmodeling/args,LGPL-3.0,2021-12-27 03:27:24,2024-07-29 15:43:36.000000,2024-07-08 20:09:54,73,2.0,2.0,6.0,46.0,,,2.0,2024-04-11 23:49:50,0.0.17,,125.0,16.0,DeepModeling dargs arguments generation.,5.0,5.0,3.0,,,,,,https://www.npmjs.com/package/@deepmodeling/args,125.0,,,,,9,True,others,3.0, +21,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 09:11:36,42,4.0,11.0,9.0,24.0,4.0,,2.0,,,,1287.0,,,8.0,8.0,4.0,https://pypi.org/project/fpop,1287.0,,,,,,,,,,9,True,others,3.0,1.0 +22,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,,,,21.0,,,,,3.0,,,,,,,,https://hub.docker.com/r/dptechnology/unifold,2024-01-08 06:24:09.367953,,683.0,7,True,others,3.0,1.0 +23,community,deepmodeling/community,,,,,https://github.com/deepmodeling/community,https://github.com/deepmodeling/community,,2021-05-06 04:50:02,2024-08-21 10:38:56.000000,2024-08-21 10:38:56,127,21.0,20.0,11.0,40.0,,2.0,79.0,,,,,,DeepModeling community content.,,,17.0,,,,,,,,,,,,7,True,others,3.0, +24,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,,7.0,2024-03-01 09:33:35,1.6,,,1.0,Repository of TBPLaS (tight-binding package for large-scale simulation).,,,10.0,,,,,,,,,,,,7,True,others,3.0, +25,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,,,,103.0,,Finite Element Analysis Library in Python.,,,57.0,https://pypi.org/project/fealpy,103.0,,,,,,,,,,7,True,others,3.0, +26,Blog,deepmodeling/blog,,,,,https://github.com/deepmodeling/blog,https://github.com/deepmodeling/blog,LGPL-3.0,2021-06-10 23:11:55,2024-07-09 21:04:11.000000,2024-07-01 21:29:34,170,3.0,7.0,6.0,102.0,,,1.0,,,,,,DeepModeling Blog.,,,7.0,,,,,,,,,,,,7,True,others,3.0, +27,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 19:01:44,143,3.0,22.0,5.0,65.0,,2.0,13.0,,,,,,Tutorials for DeepModeling projects.,,,10.0,,,,,,,,,,,,6,True,others,3.0, +28,AIS-Square,deepmodeling/AIS-Square,,,,,https://github.com/deepmodeling/AIS-Square,https://github.com/deepmodeling/AIS-Square,LGPL-3.0,2022-09-13 09:52:30,2024-08-16 07:47:57.000000,2023-12-06 03:06:55,469,,8.0,8.0,210.0,5.0,1.0,10.0,,,,,,,,,8.0,,,,,,,,,,,,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 00:32:29,2024-04-11 04:19:01.000000,2024-04-11 04:19:01,27,,7.0,5.0,22.0,,,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,,1.0,83.0,,,,,,AI for Science.,,,5.0,,,,,,,,,,,,5,True,others,3.0, +31,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,,2.0,2.0,,,,3.0,,,,,,Deep Potential driven molecular dihedral scan toolkit.,,,,,,,,,,,,,,,5,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,,6.0,2.0,2.0,4.0,2.0,11.0,,,,,,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,,7.0,5.0,12.0,,,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 d75316a..5aef4bd 100644 --- a/latest-changes.md +++ b/latest-changes.md @@ -2,19 +2,9 @@ _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._ -- ABACUS (🥇26 · ⭐ 150 · 📈) - An electronic structure package based on either plane wave basis or numerical atomic orbitals. LGPL-3.0 -- DeePTB (🥈16 · ⭐ 40 · 📈) - DeePTB: A deep learning package for tight-binding approach with ab initio accuracy. LGPL-3.0 -- GPUMD (🥉11 · ⭐ 3 · 🐣) - Graphics Processing Units Molecular Dynamics. GPL-3.0 -- dpti (🥉10 · ⭐ 19 · 📈) - A Python Package to Automate Thermodynamic Integration Calculations for Free Energy. LGPL-3.0 -- tutorials (🥉6 · ⭐ 13 · 💤) - Tutorials for DeepModeling projects. Unlicensed - -## 📉 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._ - -- dpdata (🥇23 · ⭐ 200 · 📉) - Manipulating multiple atomic simulation data formats, including DeePMD-kit, VASP, LAMMPS, ABACUS, etc. LGPL-3.0 -- reacnetgenerator (🥈19 · ⭐ 63 · 📉) - an automatic reaction network generator for reactive molecular dynamics simulation. LGPL-3.0 -- dargs (🥈19 · ⭐ 5 · 📉) - Argument processing for the deep modeling project. LGPL-3.0 -- rid-kit (🥈13 · ⭐ 42 · 📉) - Reinforced dynamics. LGPL-3.0 -- JAX-FEM (🥉11 · ⭐ 210 · 📉) - Differentiable Finite Element Method with JAX. GPL-3.0 +- DeepFlame (🥈18 · ⭐ 130 · 📈) - A deep learning empowered open-source platform for reacting flow simulations. GPL-3.0 +- DeePTB (🥈17 · ⭐ 44 · 📈) - DeePTB: A deep learning package for tight-binding approach with ab initio accuracy. LGPL-3.0 +- JAX-FEM (🥈13 · ⭐ 220 · 📈) - Differentiable Finite Element Method with JAX. GPL-3.0 +- fpop (🥉9 · ⭐ 2 · 📈) - LGPL-3.0 +- Uni-Fold (🥉7 · ⭐ 91 · 💤) - Apache-2