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Thunder-ase

Latest version: v0.8.3

Safety actively analyzes 640400 Python packages for vulnerabilities to keep your Python projects secure.

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0.6.2

0.6

* More about the usage of DFT-D3 and DFT-D4 with FIREBALL, see README.md and examples

0.5.5

* add socket_run
* set random host automatically
* use socket_run as default for MD and optimization

0.5.4

0.5.3

0.5.2

* Fix small bug: add 'label' to keyword

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