glotzerlab / softwareLinks
Conda recipes for Glotzer Lab software on HPC resources
☆12Updated 2 weeks ago
Alternatives and similar repositories for software
Users that are interested in software are comparing it to the libraries listed below
Sorting:
- Read and write GSD files for use with HOOMD-blue.☆29Updated 2 weeks ago
- A library to generate numerical descriptions of particle systems.☆12Updated 4 years ago
- A lightweight package with the periodic table of the elements☆12Updated 4 years ago
- Workflow management for signac-managed data spaces.☆48Updated 6 months ago
- Manage large and heterogeneous data spaces on the file system.☆139Updated 2 weeks ago
- Powerful, efficient particle trajectory analysis in scientific Python.☆315Updated 2 weeks ago
- A plugin that allows the use of Tensorflow in Hoomd-Blue for GPU-accelerated ML+MD☆33Updated last year
- A python wrapper around ScaLAPACK☆33Updated 3 years ago
- Rapidly visualize signac projects through a customizable dashboard interface.☆16Updated 2 weeks ago
- An AiiDA plugin for dynamically defining workflows using Python functions☆18Updated 3 years ago
- High throughput workflows and automation for HPC☆82Updated 7 months ago
- ☆19Updated 3 years ago
- Fast Azimuthal Integration in Python☆125Updated last week
- An open source toolkit for simulating RIXS spectra based on ED☆37Updated 3 months ago
- Examples for the signac framework.☆15Updated 2 weeks ago
- C++ library for the implementation of tensor product calculations through a clean, concise user interface.☆26Updated 2 years ago
- Library for steering campaigns of simulations on supercomputers☆60Updated 8 months ago
- Up-scale python functions for high-performance computing (HPC)☆69Updated this week
- Python energy landscape explorer☆100Updated 2 months ago
- ☆30Updated this week
- Extensible periodic table for python☆166Updated 2 weeks ago
- Sample molecular simulation workflows using a MoSDeF and community tools☆16Updated 3 years ago
- The Open Knowledgebase of Interatomic Models (OpenKIM) aims to be an online resource for standardized testing, long-term warehousing and …☆36Updated this week
- Find plugins for AiiDA☆18Updated last week
- PyGBe: Python, GPUs and Boundary elements for electrostatics☆69Updated 2 years ago
- Contains build scripts and instructions for software on a variety of UK HPC resources☆90Updated 2 weeks ago
- GPU-accelerated Quantum ESPRESSO using CUDA FORTRAN☆65Updated 6 years ago
- Crystal structure container and parsers for structure formats.☆35Updated 2 months ago
- Software Suite for Advanced General Ensemble Simulations☆90Updated 2 years ago
- Nested Sampling code☆34Updated 7 months ago