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Releases: ZimmermanGroup/conformer-rl

v1.1.0

05 Jun 20:17
@runxuanjiang runxuanjiang
1.1.0
4a3ac28
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v1.1.0 Latest
Latest

Added updated implementation for curriculum-learning supported agents and environments. Added docs and examples for using the curriculum learning functionality.

See #60

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v1.0.0

28 May 05:46
@runxuanjiang runxuanjiang
1.0.0
baa5fd1
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v1.0.0

First major release of conformer-rl. Includes interface for training agents on general molecules files and implementations of all components for reproducing results in "TorsionNet: A Reinforcement Learning Approach for Conformer Generation" paper.

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June 2020 TorsionNet Paper

12 Aug 05:37
@runxuanjiang runxuanjiang
0.9
92fb982
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June 2020 TorsionNet Paper Pre-release
Pre-release

State of the repository leading up to the submission of the TorsionNet paper in June 2020.

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