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Published July 25, 2024 | Version 0.1.0
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3-hydroxyflavone models to be used with ML-server

Authors/Creators

Description

3-hydroxyflavone models to be used in ML-server for ground and excited state ML/MM simulations.

  • avail_models.tar.gz contains all the data necessary to load the GPX models;
  • models_3HF.py contains the implementation of such models.

Files

Files (86.8 MB)

Name Size Download all
md5:d70433951b6c0a27ff7e6f5763e645ca
86.8 MB Download
md5:6d2c5f7a1b807f957aefac1040a26ba2
26.5 kB Download

Additional details

Dates

Available
2024-07-25

Software

Repository URL
https://github.com/Molecolab-Pisa/ML-server
Programming language
Python
Development Status
Active