A collection of workflows that are built with DFlow.
☆11May 13, 2024Updated 2 years ago
Alternatives and similar repositories for dflow-galaxy
Users that are interested in dflow-galaxy are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Towards production ready dataverse docker deployment.☆12Nov 8, 2024Updated last year
- A command line and python toolkit featured artificial intelligence × ab initio for complex chemistry systems research.☆95May 12, 2026Updated 2 weeks ago
- Natural-orbital Functional based on PySCF☆11Aug 27, 2024Updated last year
- Quantum-electrodynamical Time-dependent Density Functional Theory Within Gaussian Atomic Basis☆14May 16, 2026Updated last week
- tekton knative auto deploy demo☆15Dec 3, 2020Updated 5 years ago
- Serverless GPU API endpoints on Runpod - Get Bonus Credits • AdSkip the infrastructure headaches. Auto-scaling, pay-as-you-go, no-ops approach lets you focus on innovating your application.
- generate HPC scheduler systems jobs input scripts and submit these scripts to HPC systems and poke until they finish☆57May 18, 2026Updated last week
- ☆11Apr 27, 2023Updated 3 years ago
- DFT-D3 interface☆12Apr 3, 2023Updated 3 years ago
- efficient TDDFT-ris based on MOKIT and PySCF☆20Jan 18, 2026Updated 4 months ago
- A command line toolkit to simplify batch tasks generation and execution.☆21May 9, 2026Updated 2 weeks ago
- Simple HPC queuing system adapter for Python on based jinja templates to automate the submission script creation.☆34May 18, 2026Updated last week
- REICO-unbiased random sampling to generate diverse datasets encompassing a wide range of atomic configurations and bonding scenarios. EML…☆26Feb 14, 2025Updated last year
- ☆11Nov 10, 2020Updated 5 years ago
- 北京大学物理化学实验报告写作的参考模板。☆10Jan 10, 2021Updated 5 years ago
- End-to-end encrypted cloud storage - Proton Drive • AdSpecial offer: 40% Off Yearly / 80% Off First Month. Protect your most important files, photos, and documents from prying eyes.
- CrystalGRW: Generative Modeling of Crystal Structures with Targeted Properties via Geodesic Random Walks☆15Sep 22, 2025Updated 8 months ago
- Building MD simulations for polymer electrolyte system☆13Oct 6, 2025Updated 7 months ago
- ☆30Jul 15, 2025Updated 10 months ago
- A set of tools for analyzing molecular dynamics simulations☆13May 12, 2026Updated last week
- cp2k postprocessing tools☆79Feb 21, 2026Updated 3 months ago
- ☆29Jan 4, 2023Updated 3 years ago
- do the performance test of ABACUS☆21May 6, 2026Updated 2 weeks ago
- ☆60Mar 23, 2026Updated 2 months ago
- Enpower ABACUS calculation, for high efficiency, for high precision. Pseudopotential and Numerical Atomic Orbital library (developing)☆13Mar 27, 2026Updated last month
- End-to-end encrypted cloud storage - Proton Drive • AdSpecial offer: 40% Off Yearly / 80% Off First Month. Protect your most important files, photos, and documents from prying eyes.
- DeePMD-kit plugin for various graph neural network models☆55May 18, 2026Updated last week
- An efficient toolkit for chemical resonance analysis based on quantum chemistry calculations. It implements the quantitative theory of re…☆28Apr 13, 2023Updated 3 years ago
- SelBlocks extension for Selenium IDE☆10Feb 14, 2015Updated 11 years ago
- vinca: a generator for conda recipes for ROS☆15Updated this week
- WhereWulff: A semi-autonomous workflow for systematic catalyst surface reactivity under reaction conditions☆33Apr 8, 2024Updated 2 years ago
- Code for pre-training CharacterBERT models (as well as BERT models).☆34Sep 6, 2021Updated 4 years ago
- pyblock3: an efficient python block-sparse tensor library☆29Mar 18, 2026Updated 2 months ago
- Orbital transfer and automatic multi-reference calculation for quantum chemistry☆70May 18, 2026Updated last week
- MCP tools to connect LLMs and ABACUS jobs☆26Apr 7, 2026Updated last month
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- A 22.9 million carbon atom dataset☆16Mar 7, 2023Updated 3 years ago
- a modification version of Python Interpreter, making running Python code unpredictable and unstable.☆15Sep 1, 2022Updated 3 years ago
- ☆21Apr 5, 2025Updated last year
- Longbow is a tool for automating simulations on a remote HPC machine. Longbow is designed to mimic the normal way an application is run l…☆18Apr 13, 2026Updated last month
- DeepSPIN method for deep learning potential of magnetic systems☆19Jun 4, 2023Updated 2 years ago
- 生化环材劝退文集☆19Mar 19, 2022Updated 4 years ago
- develop a game like Tom Clancy's The Division by using Unity☆35Apr 19, 2026Updated last month