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Acellera

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https://www.acellera.com
https://www.github.com/Acellera
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AI & ML interests

AI and Simulations for Drug Discovery

Papers

AceFF: A State-of-the-Art Machine Learning Potential for Small Molecules

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Acellera: Accelerating Molecular Discovery with AI and Simulations

At Acellera, we combine cutting-edge artificial intelligence and molecular simulations to transform drug discovery and molecular design. Explore our Hugging Face space for AI models, datasets, and cutting-edge applications in molecular research.

🌟 Visit Our Website ([https://www.acellera.com])

Collections 1

AceFF Machine Learning Potentials
The best machine learning force-field for drug discovery
  • Acellera/AceFF-1.0

    Updated Jan 11
  • Acellera/AceFF-1.1

    Updated Nov 29, 2025 • 1 • 4
  • Acellera/AceFF-2.0

    Graph Machine Learning • Updated Jan 7 • 1
AceFF Machine Learning Potentials
The best machine learning force-field for drug discovery
  • Acellera/AceFF-1.0

    Updated Jan 11
  • Acellera/AceFF-1.1

    Updated Nov 29, 2025 • 1 • 4
  • Acellera/AceFF-2.0

    Graph Machine Learning • Updated Jan 7 • 1

models 4

Acellera/AceFF-1.0

Updated Jan 11

Acellera/AceFF-2.0

Graph Machine Learning • Updated Jan 7 • 1

Acellera/AceFF-1.1

Updated Nov 29, 2025 • 1 • 4

Acellera/AceForce-1.0

Updated Feb 28, 2025 • 1

datasets 0

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