NVIDIA-BioNeMo/nvMolKit
View on GitHubA high-performance, GPU-accelerated library for key computational chemistry tasks, such as molecular similarity, conformer generation, and geometry relaxation.
- Stars
- 276
- Forks
- 28
- Open beginner issues
- 0
- Indexed issues
- 5
- Avg merge
- 2d 6h
- Merged PRs (30d)
- 26
- Dominant language
- Cuda
- License
- No license data
- Last GitHub push
- Sep 19, 2026
- Latest indexed
- Sep 20, 2026
- Contributing guide
- Contributing guide
- Code of conduct
- No code of conduct
- Beginner labels
- No beginner labels indexed
5 open issues indexed
Loading issues
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Low Priority
Difficulty 5/5 Over a week Newbie friendliness 25/100
NVIDIA-BioNeMo/nvMolKit#305 ·
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Cleanup
Difficulty 3/5 1-2 days Newbie friendliness 45/100
NVIDIA-BioNeMo/nvMolKit#302 ·
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All-in-one ETKDG Openenhancement
Difficulty 4/5 3-5 days Newbie friendliness 38/100
NVIDIA-BioNeMo/nvMolKit#287 ·
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enhancement
NVIDIA-BioNeMo/nvMolKit#286 · 1 assignee ·
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enhancement
NVIDIA-BioNeMo/nvMolKit#266 · 1 assignee ·