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GitHub / deepmodeling / reacnetgenerator
an automatic reaction network generator for reactive molecular dynamics simulation
JSON API: https://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories/deepmodeling%2Freacnetgenerator
Stars: 59
Forks: 34
Open Issues: 6
License: lgpl-3.0
Language: Python
Repo Size: 31.9 MB
Dependencies:
520
Created: about 6 years ago
Updated: 3 days ago
Last pushed: 3 days ago
Last synced: 3 days ago
Commit Stats
Commits: 2063
Authors: 23
Mean commits per author: 89.7
Development Distribution Score: 0.532
More commit stats: https://commits.ecosyste.ms/hosts/GitHub/repositories/deepmodeling/reacnetgenerator
Topics: hmm, md, network, python, reaction, reactive
Files
Dependencies
- ase *
- coloredlogs *
- hmmlearn >=0.2.1
- lz4 *
- matplotlib *
- networkx *
- numpy *
- openbabel-wheel *
- packaging *
- pandas *
- rdkit *
- requests *
- scour *
- tqdm >=4.9.0
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