3D-e-Chem-VM
Workflow simulator
A virtual machine with pre-installed software and sample data for running 3D-e-Chem workflow simulations.
Virtual machine with all software and sample data to run 3D-e-Chem Knime workflows
16 stars
6 watching
3 forks
Language: Shell
last commit: about 6 years ago
Linked from 1 awesome list
Related projects:
Repository | Description | Stars |
---|---|---|
scm-nv/qmflows | Automates tasks in computational chemistry simulations | 45 |
scm-nv/plams | A toolkit for automating molecular simulation workflows and post-processing computational chemistry calculations. | 67 |
emited/flow | An implementation of a deep learning model for simulating physical processes in a way that integrates prior scientific knowledge | 54 |
dos-group/vessim | A co-simulation framework for modeling complex energy systems and their interactions with computing systems. | 49 |
ecsim/gopem | A graphical user interface for simulating PEM fuel cell systems | 33 |
mrchemsoft/mrchem | A numerical real-space code for molecular electronic structure calculations. | 30 |
mathworks-teaching-resources/virtual-controls-laboratory | An interactive teaching tool for learning control systems and simulation in MATLAB. | 70 |
pipermerriam/py-evm | A Python implementation of the Ethereum Virtual Machine. | 40 |
deqitang/pymatflow | Automates preparation and submission of DFT calculations for materials science simulations | 5 |
brockelmore/solvm | An experimental implementation of a miniature EVM inside another EVM using Solidity and YUL | 228 |
cogenda/suprem4 | A software package that simulates semiconductor process conditions | 32 |
lammps/lammps | A parallel molecular dynamics simulation code designed to efficiently run on multiple computers. | 2,239 |
digego/extempore | An environment for programming and simulating complex systems in real-time. | 1,404 |
geekq/workflow | An API for modeling and interacting with workflow states and transitions in a state-machine-inspired way | 1,763 |
umass-foundation-model/3d-llm | Developing a Large Language Model capable of processing 3D representations as inputs | 961 |