Row is a command line tool that helps you manage workflows on HPC resources.
☆19Aug 8, 2026Updated this week
Alternatives and similar repositories for row
Users that are interested in row are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Molecular dynamics and Monte Carlo soft matter simulation in Rust.☆18Updated this week
- Parallel programming with Python exercises☆13Feb 18, 2025Updated last year
- Repository for material from the 2022 MC/MD Summer Workshop☆14Jul 12, 2024Updated 2 years ago
- Python module for identification of conserved water molecules from molecular dynamics trajectories.☆15Jul 30, 2026Updated last week
- Sample molecular simulation workflows using a MoSDeF and community tools☆17Jul 19, 2022Updated 4 years ago
- Wordpress hosting with auto-scaling - Free Trial Offer • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- Collection of tools to help initialize and manipulate geometries in two and three dimensions.☆25Jul 29, 2026Updated last week
- NanoOpt: Deriving potentials for coarse-grained nanoparticles via potential-matching☆11Oct 8, 2021Updated 4 years ago
- Python interface for Enhanced Monte Carlo (EMC)☆24Jul 13, 2026Updated 3 weeks ago
- Set of tools for input preparation for conserved water search from MD trajectories (gromacs, amber) and their analysis☆20Updated this week
- Packs stuff in boxes☆24Jul 7, 2026Updated last month
- Tools for polymer molecular dynamics simulations☆16Jul 20, 2026Updated 3 weeks ago
- Material for the 3rd i-CoMSE Workshop: Methods for Advanced Sampling☆42May 1, 2023Updated 3 years ago
- Conda package for artifact creation that enables offline environments. Ideal for air-gapped deployments.☆15Sep 23, 2024Updated last year
- Coarse-Grained SMILES (CGsmiles) A Versatile Line Notation for Molecular Representations Across Multiple Resolutions☆17Updated this week
- Open source password manager - Proton Pass • AdSecurely store, share, and autofill your credentials with Proton Pass, the end-to-end encrypted password manager trusted by millions.
- 6800% faster "os" module replacement. A drop-in replacement for Python's standard 'OS' module. Fully-rewritten, optimized, and speeded-up…☆18Feb 20, 2023Updated 3 years ago
- A HOOMD-blue component for soft matter simulations.☆27Jul 31, 2026Updated last week
- A collection of molecular optimisers and property calculators for use with stk.☆24May 18, 2026Updated 2 months ago
- QUASAR is an autonomous system for end-to-end scientific discovery, integrating LLMs with simulation tools to automate workflows across q…☆18May 26, 2026Updated 2 months ago
- This repo contains the codes to run solvation free energy prediction.☆13May 1, 2022Updated 4 years ago
- OpenMM plugin to interface with XTB☆20Nov 5, 2025Updated 9 months ago
- A Python library for constructing polymer topologies and coordinates☆22Sep 23, 2025Updated 10 months ago
- A package for deriving coarse-grain potentials using MultiState Iterative Boltzmann Inversion (MS-IBI)☆20Jun 2, 2026Updated 2 months ago
- Bayesian Multistate Bennett Acceptance Ratio Method☆16Jun 28, 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.
- QM-based enzyme model generation and validation.☆21Jun 5, 2026Updated 2 months ago
- ☆11Dec 27, 2023Updated 2 years ago
- High-performance operations for neural network potentials☆102Jun 9, 2026Updated 2 months ago
- Repository for collecting materials from nwb hackathons☆25Nov 7, 2025Updated 9 months ago
- Robust Equilibration Detection☆29Updated this week
- 3D point cloud registration tool☆11Feb 8, 2021Updated 5 years ago
- Angel - a symmetrical staggered ergonomic keyboard.☆13Jan 27, 2021Updated 5 years ago
- A Los Angeles Times theme for Python's Altair statistical visualization library☆12May 20, 2021Updated 5 years ago
- Showing how to integrate CMake, C++, and pybind11☆11May 1, 2018Updated 8 years ago
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- Python electron spectroscopy (particularly ARPES) analysis toolkit developed by King group at St Andrews☆17Updated this week
- Microbenchmarks showing relative performance of different Python functions/patterns.☆13Oct 3, 2025Updated 10 months ago
- Powerful, efficient particle trajectory analysis in scientific Python.☆326Updated this week
- ☆10Aug 29, 2021Updated 4 years ago
- BigSMILES☆11Jun 16, 2024Updated 2 years ago
- Timewarp is a research project using deep learning to accelerate molecular dynamics simulation.☆67Aug 21, 2024Updated last year
- 🌈 Highlights similar variables on focus☆13Apr 23, 2023Updated 3 years ago