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Pull requests: uw-ipd/tmol

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Pull requests list

Aleaverfay/colab install
#384 opened Jun 5, 2026 by aleaverfay Collaborator Loading…
1
Key on hash of cart-bonded params in PBT caching
#383 opened Jun 4, 2026 by aleaverfay Collaborator Loading…
4
Ncorley/lig rdkit fix
#382 opened Jun 3, 2026 by kierandidi Collaborator Loading…
1
Add pose_stack_from_backbone_coords: in-memory PoseStack construction from N/CA/C/O
#380 opened May 23, 2026 by ssiddhantsharma Loading…
Aleaverfay/bump check
#363 opened Apr 14, 2026 by aleaverfay Collaborator Loading…
1
Kdidi/ligand clean
#361 opened Apr 12, 2026 by kierandidi Collaborator Loading…
18
Support for Apple Silicon (Metal/MPS)
#357 opened Apr 5, 2026 by fnachon Loading…
Aleaverfay/dlin2
#349 opened Mar 16, 2026 by aleaverfay Collaborator Loading…
2
bugfix for kintree stencil creation
#319 opened Jun 20, 2025 by aleaverfay Collaborator Loading…
1
C++/CUDA pre-built binaries
#316 opened May 7, 2025 by jflat06 Collaborator Loading…
1
First attempt at resetting R3 count-pair style i to i+2 connectivity
#313 opened Mar 7, 2025 by aleaverfay Collaborator Loading…
Add coordinate constraint support
#312 opened Mar 7, 2025 by aleaverfay Collaborator Loading…
RF2 Integration
#298 opened Apr 17, 2024 by jflat06 Collaborator Loading…
Torsion space optimization (WIP)
#295 opened Apr 12, 2024 by fdimaio Collaborator Loading…
2 tasks
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