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zeomod Public
A professional tool for automated modeling of mesoporous zeolites, intelligent passivation, and topology-guided doping
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mace Public
Forked from ACEsuit/maceMACE - Fast and accurate machine learning interatomic potentials with higher order equivariant message passing.
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Some intersting scripts for computational chemistry workflow or some related python code
UpdatedJul 3, 2025 -
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maml Public
Forked from materialsvirtuallab/mamlPython for Materials Machine Learning, Materials Descriptors, Machine Learning Force Fields, Deep Learning, etc.
Jupyter Notebook BSD 3-Clause "New" or "Revised" License UpdatedMar 26, 2025 -
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tuning_playbook Public
Forked from google-research/tuning_playbookA playbook for systematically maximizing the performance of deep learning models.
Other UpdatedFeb 3, 2023 -
LASP_autotrain_lib Public
Forked from QuantumMisaka/LASP_autotrain_libLASP python library including scripts and auto-NNtrain workflow
Python MIT License UpdatedSep 25, 2022 -
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phorbol.github.io Public
Forked from klovien/klovien.github.io本项目为Pages静态博客示范，对应的演示网站地址为 👉
HTML MIT License UpdatedJun 25, 2022
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