From 405356cb54f7b06408040138b29cf91d91e5b524 Mon Sep 17 00:00:00 2001 From: njzjz Date: Thu, 7 Nov 2024 18:15:32 +0000 Subject: [PATCH] Update best-of list for version 2024.11.07 --- README.md | 176 ++++++++++++++++---------------- history/2024-11-07_changes.md | 17 +++ history/2024-11-07_projects.csv | 39 +++++++ latest-changes.md | 11 +- 4 files changed, 151 insertions(+), 92 deletions(-) create mode 100644 history/2024-11-07_changes.md create mode 100644 history/2024-11-07_projects.csv diff --git a/README.md b/README.md index 2226f38..efad02b 100644 --- a/README.md +++ b/README.md @@ -46,20 +46,20 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K
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 · 📋 800 - 9% open · ⏱️ 17.09.2024): +- [GitHub](https://github.com/deepmodeling/deepmd-kit) (👨‍💻 69 · 🔀 490 · 📥 42K · 📦 20 · 📋 810 - 9% open · ⏱️ 17.09.2024): ``` git clone https://github.com/deepmodeling/deepmd-kit ``` -- [PyPi](https://pypi.org/project/deepmd-kit) (📥 11K / month): +- [PyPi](https://pypi.org/project/deepmd-kit) (📥 10K / month): ``` pip install deepmd-kit ``` -- [Conda](https://anaconda.org/conda-forge/deepmd-kit) (📥 1.2M · ⏱️ 25.09.2024): +- [Conda](https://anaconda.org/conda-forge/deepmd-kit) (📥 1.2M · ⏱️ 03.11.2024): ``` conda install -c conda-forge deepmd-kit ``` -- [npm](https://www.npmjs.com/package/deepmd-kit) (📥 4 / month): +- [npm](https://www.npmjs.com/package/deepmd-kit) (📥 5 / month): ``` npm install deepmd-kit ``` @@ -70,28 +70,28 @@ 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 · ⏱️ 31.10.2024): +- [GitHub](https://github.com/deepmodeling/abacus-develop) (👨‍💻 120 · 🔀 130 · 📋 2K - 7% open · ⏱️ 07.11.2024): ``` git clone https://github.com/deepmodeling/abacus-develop ``` -- [Conda](https://anaconda.org/conda-forge/abacus) (📥 220K · ⏱️ 30.09.2024): +- [Conda](https://anaconda.org/conda-forge/abacus) (📥 220K · ⏱️ 07.11.2024): ``` conda install -c conda-forge abacus ```
-
dpdata (🥇25 · ⭐ 200 · 📈) - A Python package for manipulating atomistic data of software in computational science. LGPL-3.0 +
dpdata (🥇25 · ⭐ 200) - A Python package for manipulating atomistic data of software in computational science. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dpdata) (👨‍💻 61 · 🔀 120 · 📦 130 · 📋 100 - 20% open · ⏱️ 20.09.2024): +- [GitHub](https://github.com/deepmodeling/dpdata) (👨‍💻 61 · 🔀 130 · 📦 130 · 📋 100 - 20% open · ⏱️ 20.09.2024): ``` git clone https://github.com/deepmodeling/dpdata ``` -- [PyPi](https://pypi.org/project/dpdata) (📥 58K / month): +- [PyPi](https://pypi.org/project/dpdata) (📥 71K / month): ``` pip install dpdata ``` -- [Conda](https://anaconda.org/conda-forge/dpdata) (📥 80K · ⏱️ 21.09.2024): +- [Conda](https://anaconda.org/conda-forge/dpdata) (📥 81K · ⏱️ 21.09.2024): ``` conda install -c conda-forge dpdata ``` @@ -100,14 +100,14 @@ 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 · ⭐ 44) - 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): ``` git clone https://github.com/deepmodeling/dpdispatcher ``` -- [PyPi](https://pypi.org/project/dpdispatcher) (📥 7.1K / month): +- [PyPi](https://pypi.org/project/dpdispatcher) (📥 6.8K / month): ``` pip install dpdispatcher ``` @@ -120,14 +120,14 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K docker pull dptechnology/dpdispatcher ```
-
DP-GEN (🥈22 · ⭐ 300) - 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) (👨‍💻 64 · 🔀 170 · 📥 1.8K · 📦 7 · 📋 300 - 12% open · ⏱️ 10.04.2024): +- [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) (📥 1.6K / month): +- [PyPi](https://pypi.org/project/dpgen) (📥 1.5K / month): ``` pip install dpgen ``` @@ -138,12 +138,12 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K
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 · ⏱️ 20.10.2024): +- [GitHub](https://github.com/deepmodeling/reacnetgenerator) (👨‍💻 18 · 🔀 39 · 📦 3 · 📋 120 - 4% open · ⏱️ 31.10.2024): ``` git clone https://github.com/deepmodeling/reacnetgenerator ``` -- [PyPi](https://pypi.org/project/reacnetgenerator) (📥 8.2K / month): +- [PyPi](https://pypi.org/project/reacnetgenerator) (📥 6.5K / month): ``` pip install reacnetgenerator ``` @@ -152,7 +152,7 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K conda install -c conda-forge reacnetgenerator ```
-
dflow (🥈19 · ⭐ 63) - Dflow is a Python framework for constructing scientific computing workflows (e.g. concurrent learning workflows).. LGPL-3.0 +
dflow (🥈19 · ⭐ 64) - 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): @@ -172,9 +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 + +- [GitHub](https://github.com/deepmodeling/dargs) (👨‍💻 7 · 🔀 3 · 📦 130 · 📋 8 - 25% open · ⏱️ 28.10.2024): + + ``` + git clone https://github.com/deepmodeling/dargs + ``` +- [PyPi](https://pypi.org/project/dargs) (📥 71K / month): + ``` + pip install dargs + ``` +- [Conda](https://anaconda.org/conda-forge/dargs) (📥 33K · ⏱️ 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 · ⏱️ 12.10.2024): +- [GitHub](https://github.com/deepmodeling/deepflame-dev) (👨‍💻 24 · 🔀 61 · 📋 48 - 39% open · ⏱️ 03.11.2024): ``` git clone https://github.com/deepmodeling/deepflame-dev @@ -187,7 +203,7 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K ``` git clone https://github.com/deepmodeling/dpgen2 ``` -- [PyPi](https://pypi.org/project/dpgen2) (📥 690 / month): +- [PyPi](https://pypi.org/project/dpgen2) (📥 640 / month): ``` pip install dpgen2 ``` @@ -196,35 +212,31 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K docker pull dptechnology/dpgen2 ```
-
dargs (🥈17 · ⭐ 5 · 📉) - Argument processing for the deep modeling project. LGPL-3.0 +
DeePTB (🥈16 · ⭐ 54) - DeePTB: A deep learning package for tight-binding approach with ab initio accuracy. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dargs) (👨‍💻 7 · 🔀 3 · 📦 130 · 📋 8 - 25% open · ⏱️ 28.10.2024): +- [GitHub](https://github.com/deepmodeling/DeePTB) (👨‍💻 10 · 🔀 16 · 📦 2 · 📋 38 - 26% open · ⏱️ 03.10.2024): ``` - git clone https://github.com/deepmodeling/dargs - ``` -- [PyPi](https://pypi.org/project/dargs) (📥 55K / month): - ``` - pip install dargs + git clone https://github.com/deepmodeling/DeePTB ``` -- [Conda](https://anaconda.org/conda-forge/dargs) (📥 33K · ⏱️ 15.07.2024): +- [PyPi](https://pypi.org/project/dptb) (📥 600 / month): ``` - conda install -c conda-forge dargs + pip install dptb ```
-
DeePTB (🥈16 · ⭐ 52) - DeePTB: A deep learning package for tight-binding approach with ab initio accuracy. LGPL-3.0 +
JAX-FEM (🥈15 · ⭐ 280) - Differentiable Finite Element Method with JAX. GPL-3.0 -- [GitHub](https://github.com/deepmodeling/DeePTB) (👨‍💻 10 · 🔀 15 · 📦 2 · 📋 36 - 22% open · ⏱️ 03.10.2024): +- [GitHub](https://github.com/deepmodeling/jax-fem) (👨‍💻 8 · 🔀 43 · 📦 3 · 📋 35 - 62% open · ⏱️ 30.10.2024): ``` - git clone https://github.com/deepmodeling/DeePTB + git clone https://github.com/deepmodeling/jax-fem ``` -- [PyPi](https://pypi.org/project/dptb) (📥 580 / month): +- [PyPi](https://pypi.org/project/jax-fem) (📥 730 / month): ``` - pip install dptb + pip install jax-fem ```
-
APEX (🥈16 · ⭐ 23) - APEX: Alloy Properties EXplorer using simulations. LGPL-3.0 +
APEX (🥈15 · ⭐ 23 · 📉) - APEX: Alloy Properties EXplorer using simulations. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/APEX) (👨‍💻 6 · 🔀 16 · 📦 2 · ⏱️ 25.10.2024): @@ -236,18 +248,6 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K pip install apex-flow ```
-
JAX-FEM (🥈15 · ⭐ 280) - Differentiable Finite Element Method with JAX. GPL-3.0 - -- [GitHub](https://github.com/deepmodeling/jax-fem) (👨‍💻 8 · 🔀 42 · 📦 3 · 📋 35 - 62% open · ⏱️ 30.10.2024): - - ``` - git clone https://github.com/deepmodeling/jax-fem - ``` -- [PyPi](https://pypi.org/project/jax-fem) (📥 710 / month): - ``` - pip install jax-fem - ``` -
DMFF (🥈14 · ⭐ 150 · 💤) - 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 · 🔀 42 · 📋 26 - 38% open · ⏱️ 12.01.2024): @@ -260,68 +260,68 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K conda install -c conda-forge dmff ```
-
rid-kit (🥈14 · ⭐ 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) (📥 880 / month): +- [PyPi](https://pypi.org/project/rid-kit) (📥 730 / month): ``` pip install rid-kit ```
-
DP-GUI (🥉13 · ⭐ 7) - A web-based GUI for user inputs. LGPL-3.0 +
DP-GUI (🥈13 · ⭐ 7) - A web-based GUI for user inputs. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/dpgui) (👨‍💻 4 · 🔀 5 · 📦 9 · ⏱️ 11.09.2024): ``` git clone https://github.com/deepmodeling/dpgui ``` -- [PyPi](https://pypi.org/project/dpgui) (📥 31K / month): +- [PyPi](https://pypi.org/project/dpgui) (📥 40K / month): ``` pip install dpgui ```
-
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) (📥 4.2K / month): +- [PyPi](https://pypi.org/project/deepmodeling_sphinx) (📥 4.6K / month): ``` pip install deepmodeling_sphinx ```
-
dpti (🥉11 · ⭐ 22) - A Python Package to Automate Thermodynamic Integration Calculations for Free Energy. LGPL-3.0 +
GPUMD (🥉11 · ⭐ 3 · 🐣) - Graphics Processing Units Molecular Dynamics. GPL-3.0 -- [GitHub](https://github.com/deepmodeling/dpti) (👨‍💻 19 · 🔀 19 · 📦 2 · ⏱️ 14.08.2024): +- [GitHub](https://github.com/deepmodeling/GPUMD) (👨‍💻 35 · ⏱️ 30.10.2024): ``` - git clone https://github.com/deepmodeling/dpti - ``` -- [PyPi](https://pypi.org/project/dpti) (📥 290 / month): - ``` - pip install dpti + git clone https://github.com/deepmodeling/GPUMD ```
-
GPUMD (🥉11 · ⭐ 3 · 🐣) - Graphics Processing Units Molecular Dynamics. GPL-3.0 +
DeePKS-kit (🥉10 · ⭐ 100 · 💤) - a package for developing machine learning-based chemically accurate energy and density functional models. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/GPUMD) (👨‍💻 35 · ⏱️ 30.10.2024): +- [GitHub](https://github.com/deepmodeling/deepks-kit) (👨‍💻 7 · 🔀 36 · 📋 21 - 33% open · ⏱️ 13.04.2024): ``` - git clone https://github.com/deepmodeling/GPUMD + git clone https://github.com/deepmodeling/deepks-kit ```
-
DeePKS-kit (🥉10 · ⭐ 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 · 📋 20 - 30% open · ⏱️ 13.04.2024): +- [GitHub](https://github.com/deepmodeling/dpti) (👨‍💻 19 · 🔀 19 · 📦 2 · ⏱️ 14.08.2024): ``` - git clone https://github.com/deepmodeling/deepks-kit + git clone https://github.com/deepmodeling/dpti + ``` +- [PyPi](https://pypi.org/project/dpti) (📥 270 / month): + ``` + pip install dpti ```
fpop (🥉9 · ⭐ 2) - LGPL-3.0 @@ -331,7 +331,7 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K ``` git clone https://github.com/deepmodeling/fpop ``` -- [PyPi](https://pypi.org/project/fpop) (📥 2.4K / month): +- [PyPi](https://pypi.org/project/fpop) (📥 2.3K / month): ``` pip install fpop ``` @@ -344,14 +344,14 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K git clone https://github.com/deepmodeling/community ```
-
fealpy (🥉8 · ⭐ 3) - Finite Element Analysis Library in Python. Unlicensed +
fealpy (🥉8 · ⭐ 3 · 💤) - Finite Element Analysis Library in Python. Unlicensed - [GitHub](https://github.com/deepmodeling/fealpy) (👨‍💻 57 · 🔀 2 · ⏱️ 24.04.2024): ``` git clone https://github.com/deepmodeling/fealpy ``` -- [PyPi](https://pypi.org/project/fealpy) (📥 580 / month): +- [PyPi](https://pypi.org/project/fealpy) (📥 480 / month): ``` pip install fealpy ``` @@ -363,37 +363,29 @@ 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) (📥 44 / month): +- [npm](https://www.npmjs.com/package/@deepmodeling/args) (📥 65 / month): ``` npm install @deepmodeling/args ```
-
Uni-Fold (🥉7 · ⭐ 91 · 💤) - Apache-2 +
Blog (🥉8 · ⭐ 1 · 📈) - DeepModeling Blog. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/Uni-Fold) (👨‍💻 3 · 🔀 18 · ⏱️ 18.08.2022): +- [GitHub](https://github.com/deepmodeling/blog) (👨‍💻 8 · 🔀 8 · ⏱️ 07.11.2024): ``` - git clone https://github.com/deepmodeling/Uni-Fold - ``` -- [Docker Hub](https://hub.docker.com/r/dptechnology/unifold) (📥 770 · ⏱️ 08.01.2024): - ``` - docker pull dptechnology/unifold + git clone https://github.com/deepmodeling/blog ```
-
Blog (🥉7 · ⭐ 1) - DeepModeling Blog. LGPL-3.0 +
Uni-Fold (🥉7 · ⭐ 91 · 💤) - Apache-2 -- [GitHub](https://github.com/deepmodeling/blog) (👨‍💻 7 · 🔀 7 · ⏱️ 11.09.2024): +- [GitHub](https://github.com/deepmodeling/Uni-Fold) (👨‍💻 3 · 🔀 18 · ⏱️ 18.08.2022): ``` - git clone https://github.com/deepmodeling/blog + git clone https://github.com/deepmodeling/Uni-Fold ``` -
-
tutorials (🥉6 · ⭐ 13) - Tutorials for DeepModeling projects. Unlicensed - -- [GitHub](https://github.com/deepmodeling/tutorials) (👨‍💻 10 · 🔀 22 · ⏱️ 21.08.2024): - +- [Docker Hub](https://hub.docker.com/r/dptechnology/unifold) (📥 770 · ⏱️ 08.01.2024): ``` - git clone https://github.com/deepmodeling/tutorials + docker pull dptechnology/unifold ```
AIS-Square (🥉6 · ⭐ 12 · 💤) - LGPL-3.0 @@ -412,7 +404,7 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K git clone https://github.com/deepmodeling/tbplas ```
-
DeePDih (🥉6 · ⭐ 4 · 📈) - Deep Potential driven molecular dihedral scan toolkit. MIT +
DeePDih (🥉6 · ⭐ 4 · 💤) - Deep Potential driven molecular dihedral scan toolkit. MIT - [GitHub](https://github.com/deepmodeling/DeePDih) (🔀 3 · ⏱️ 19.04.2024): @@ -436,7 +428,15 @@ This curated list contains 38 awesome open-source projects with a total of 3.5K git clone https://github.com/deepmodeling/AI4Science101 ```
-
DeepH-pack (🥉4 · ⭐ 11 · 💤) - Deep neural networks for density functional theory Hamiltonian. LGPL-3.0 +
tutorials (🥉4 · ⭐ 13 · 📉) - Tutorials for DeepModeling projects. Unlicensed + +- [GitHub](https://github.com/deepmodeling/tutorials) (👨‍💻 10 · 🔀 22 · 📋 3 - 33% open · ⏱️ 21.08.2024): + + ``` + git clone https://github.com/deepmodeling/tutorials + ``` +
+
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/2024-11-07_changes.md b/history/2024-11-07_changes.md new file mode 100644 index 0000000..896a6ef --- /dev/null +++ b/history/2024-11-07_changes.md @@ -0,0 +1,17 @@ +## 📈 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._ + +- dargs (🥈18 · ⭐ 5 · 📈) - Argument processing for the deep modeling project. LGPL-3.0 +- Blog (🥉8 · ⭐ 1 · 📈) - DeepModeling Blog. 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 + diff --git a/history/2024-11-07_projects.csv b/history/2024-11-07_projects.csv new file mode 100644 index 0000000..c62361a --- /dev/null +++ b/history/2024-11-07_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 15:23:44,2024-11-07 11:04:43.000000,2024-09-17 18:00:40,2534,1.0,493.0,47.0,2144.0,73.0,737.0,1491.0,2024-07-03 19:22:15,2.2.11,42498.0,38181.0,50.0,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,9992.0,https://anaconda.org/conda-forge/deepmd-kit,2024-11-03 06:25:04.992,1179984.0,https://www.npmjs.com/package/deepmd-kit,5.0,https://hub.docker.com/r/deepmodeling/deepmd-kit,2024-07-27 08:24:51.741318,1.0,2933.0,26,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 04:04:52,2024-11-07 14:24:20.000000,2024-11-07 14:24:20,6838,213.0,132.0,11.0,3330.0,147.0,1840.0,172.0,2024-11-04 03:04:11,3.8.2,,13953.0,59.0,An electronic structure package based on either plane wave basis or numerical atomic orbitals.,,,120.0,,,https://anaconda.org/conda-forge/abacus,2024-11-07 06:50:41.462,223248.0,,,,,,,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 13:24:23,2024-11-07 06:22:15.000000,2024-09-20 18:23:06,761,25.0,126.0,9.0,519.0,21.0,83.0,199.0,2024-09-20 18:24:21,0.2.21,,72326.0,37.0,A Python package for manipulating atomistic data of software in computational science.,128.0,128.0,61.0,https://pypi.org/project/dpdata,70731.0,https://anaconda.org/conda-forge/dpdata,2024-09-21 05:04:04.171,80886.0,,,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 05:14:37,2024-11-04 22:36:04.000000,2024-10-28 19:13:50,1097,15.0,54.0,6.0,400.0,16.0,63.0,44.0,2024-08-30 18:52:29,0.6.7,,9795.0,47.0,generate HPC scheduler systems jobs input scripts and submit these scripts to HPC systems and poke until they finish.,52.0,52.0,47.0,https://pypi.org/project/dpdispatcher,6816.0,https://anaconda.org/conda-forge/dpdispatcher,2024-08-31 12:30:44.164,16426.0,,,https://hub.docker.com/r/dptechnology/dpdispatcher,2024-08-30 18:56:38.463169,,110362.0,24,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 11:43:56,2024-11-06 03:52:14.000000,2024-11-04 01:14:45,2084,1.0,168.0,13.0,853.0,35.0,265.0,306.0,2024-04-10 06:37:07,0.12.1,1815.0,2135.0,18.0,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,1474.0,https://anaconda.org/conda-forge/dpgen,2024-04-10 09:44:30.012,33445.0,,,,,,,21,True,others,2.0,-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 15:07:56,2024-11-04 22:36:31.000000,2024-10-31 20:17:03,2501,14.0,39.0,9.0,2152.0,5.0,120.0,67.0,2024-10-03 19:33:36,1.6.14,,14650.0,100.0,an automatic reaction network generator for reactive molecular dynamics simulation.,3.0,3.0,18.0,https://pypi.org/project/reacnetgenerator,6488.0,https://anaconda.org/conda-forge/reacnetgenerator,2024-10-04 04:12:50.002,440762.0,,,,,,,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 08:44:49,2130,62.0,26.0,1.0,843.0,14.0,21.0,64.0,2024-10-31 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,,9276.0,19,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 22:20:28,2024-11-04 22:37:55.000000,2024-10-28 19:14:03,153,2.0,3.0,7.0,71.0,2.0,6.0,5.0,2024-07-15 00:16:52,0.4.8,,71741.0,29.0,Argument processing for the deep modeling project.,129.0,129.0,7.0,https://pypi.org/project/dargs,70968.0,https://anaconda.org/conda-forge/dargs,2024-07-15 04:32:31.846,33250.0,,,,,,,18,True,others,2.0,1.0 +8,DeepFlame,deepmodeling/deepflame-dev,,,,,https://github.com/deepmodeling/deepflame-dev,https://github.com/deepmodeling/deepflame-dev,GPL-3.0,2022-06-12 10:25:12,2024-11-05 08:57:20.000000,2024-11-03 08:29:00,1116,51.0,61.0,6.0,474.0,19.0,29.0,137.0,2024-08-23 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 03:39:33,324,21.0,25.0,7.0,233.0,9.0,23.0,33.0,2023-01-28 03:43:25,0.0.7,,746.0,7.0,2nd generation of the Deep Potential GENerator.,5.0,5.0,14.0,https://pypi.org/project/dpgen2,637.0,,,,,,https://hub.docker.com/r/dptechnology/dpgen2,2024-10-29 04:22:10.046736,,3608.0,17,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 03:19:42,2024-10-03 18:52:57.000000,2024-10-03 18:52:57,748,26.0,16.0,3.0,177.0,10.0,28.0,54.0,2024-08-15 03:02:38,2.1.1,,602.0,11.0,DeePTB: A deep learning package for tight-binding approach with ab initio accuracy.,2.0,2.0,10.0,https://pypi.org/project/dptb,602.0,,,,,,,,,,16,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 15:20:54,2024-10-30 02:47:21.000000,2024-10-30 02:47:14,205,15.0,43.0,14.0,5.0,22.0,13.0,281.0,,,,728.0,,Differentiable Finite Element Method with JAX.,3.0,3.0,8.0,https://pypi.org/project/jax-fem,728.0,,,,,,,,,,15,True,others,2.0, +12,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 03:40:57,591,22.0,16.0,7.0,77.0,,8.0,23.0,2024-05-06 10:01:52,1.2.0,,6595.0,4.0,APEX: Alloy Properties EXplorer using simulations.,2.0,2.0,6.0,https://pypi.org/project/apex-flow,6595.0,,,,,,,,,,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,,112.0,4.0,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 07:33:02.470,1126.0,,,,,,,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 03:25:35,0.6.4,145.0,732.0,5.0,Reinforced dynamics.,2.0,2.0,14.0,https://pypi.org/project/rid-kit,729.0,,,,,,,,,,13,True,others,2.0,-1.0 +15,DP-GUI,deepmodeling/dpgui,dpgui,,,,https://github.com/deepmodeling/dpgui,https://github.com/deepmodeling/dpgui,LGPL-3.0,2021-07-21 18:48:23,2024-11-04 22:36:19.000000,2024-09-11 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,,39796.0,4.0,A web-based GUI for user inputs.,9.0,9.0,4.0,https://pypi.org/project/dpgui,39796.0,,,,,,,,,,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 00:19:06,2024-11-04 22:36:01.000000,2024-10-27 22:37:03,76,5.0,7.0,5.0,68.0,,,3.0,2024-10-27 22:37:32,0.3.0,,4585.0,24.0,Sphinx extension for DeepModeling projects.,,,7.0,https://pypi.org/project/deepmodeling_sphinx,4585.0,,,,,,,,,,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 21:16:48,4195,268.0,,,,,,3.0,,,,,,Graphics Processing Units Molecular Dynamics.,,,35.0,,,,,,,,,,,,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 13:57:37,2024-11-04 22:36:20.000000,2024-08-14 03:08:53,406,1.0,19.0,7.0,71.0,9.0,,22.0,,,,268.0,,A Python Package to Automate Thermodynamic Integration Calculations for Free Energy.,2.0,2.0,19.0,https://pypi.org/project/dpti,268.0,,,,,,,,,,10,True,others,3.0,-1.0 +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,,,,2266.0,,,10.0,10.0,4.0,https://pypi.org/project/fpop,2266.0,,,,,,,,,,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 09:19:17,137,13.0,21.0,11.0,42.0,,2.0,82.0,,,,,,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,,,,482.0,,Finite Element Analysis Library in Python.,,,57.0,https://pypi.org/project/fealpy,482.0,,,,,,,,,,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,,65.0,16.0,DeepModeling dargs arguments generation.,5.0,5.0,3.0,,,,,,https://www.npmjs.com/package/@deepmodeling/args,65.0,,,,,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 23:11:55,2024-11-07 01:12:13.000000,2024-11-07 01:12:11,184,14.0,8.0,6.0,116.0,,,1.0,,,,,,DeepModeling Blog.,,,8.0,,,,,,,,,,,,8,True,others,3.0,1.0 +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,,,,21.0,,,,,3.0,,,,,,,,https://hub.docker.com/r/dptechnology/unifold,2024-01-08 06:24:09.367953,,769.0,7,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 09:52:30,2024-11-06 04:25:44.000000,2023-12-06 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 19:01:44,143,1.0,22.0,5.0,67.0,1.0,2.0,13.0,,,,,,Tutorials for DeepModeling projects.,,,10.0,,,,,,,,,,,,4,True,others,3.0,-2.0 +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 4dbcd81..896a6ef 100644 --- a/latest-changes.md +++ b/latest-changes.md @@ -2,13 +2,16 @@ _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._ -- dpdata (🥇25 · ⭐ 200 · 📈) - A Python package for manipulating atomistic data of software in computational science. LGPL-3.0 -- 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 -- DeePDih (🥉6 · ⭐ 4 · 📈) - Deep Potential driven molecular dihedral scan toolkit. MIT +- dargs (🥈18 · ⭐ 5 · 📈) - Argument processing for the deep modeling project. LGPL-3.0 +- Blog (🥉8 · ⭐ 1 · 📈) - DeepModeling Blog. 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 (🥈17 · ⭐ 5 · 📉) - Argument processing for the deep modeling project. 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 +- 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