Skip to content

Pull requests: deepchem/deepchem

New pull request New
632 Open 2,589 Closed
632 Open 2,589 Closed
Author
Filter by author
Loading
Label
Filter by label
Loading
Use alt + click/return to exclude labels
or ⇧ + click/return for logical OR
Projects
Filter by project
Loading
Milestones
Filter by milestone
Loading
Reviews
Filter by reviews
No reviews Review required Approved review Changes requested
Assignee
Filter by who’s assigned
Assigned to nobody Loading
Sort
Sort by
Newest Oldest Most commented Least commented Recently updated Least recently updated Best match
Most reactions
👍 👎 😄 🎉 😕 ❤️ 🚀 👀

Pull requests list

Add NequIP model skeleton
#5096 opened Aug 16, 2026 by Satvik24511 Contributor • Draft
12 of 15 tasks
Fix bare except clauses in torch_models (follow-up to #3137)
#5095 opened Aug 16, 2026 by Shiva9801 Loading…
4 of 15 tasks
1
Fix AtomicConv applying dropout during eval
#5094 opened Aug 12, 2026 by chiruu12 Loading…
1
1
HF Tests Fixes
#5093 opened Aug 12, 2026 by priyadp1 Contributor Loading…
4 of 15 tasks
Fix infomax optimizer bug
#5090 opened Aug 11, 2026 by Ritesh-1127 Loading…
12 of 15 tasks
1
1
Upgraded transformers version
#5088 opened Aug 10, 2026 by priyadp1 Contributor Loading…
2 of 15 tasks
Fix ScScore dropout during evaluation
#5087 opened Aug 9, 2026 by Shivansh-thecoder Loading…
6 of 9 tasks
1
Fix for the Failing hf CIs
#5085 opened Aug 9, 2026 by Zrahay Contributor • Draft
9 of 15 tasks
Fixed import conventions for molformer to fix hf-test ci failures
#5084 opened Aug 5, 2026 by shubham-bari Contributor • Draft
11 of 15 tasks
Initial Functions and Classes for ProteinMPNN Model
#5083 opened Aug 5, 2026 by shubham-bari Contributor Loading…
11 of 15 tasks
5
Fix broken logger call in ButinaSplitter.split
#5081 opened Aug 4, 2026 by deepak0x Loading…
3 tasks done
1
Fix misspelled DTNNEmbedding initalizer parameter
#5080 opened Aug 3, 2026 by shivamsingh-007 Loading…
4 of 6 tasks
1
6
OLMo Benchmarking Script
#5079 opened Aug 3, 2026 by priyadp1 Contributor Loading…
7 of 15 tasks
docs: align editable-install instructions with pip install -e .
#5078 opened Aug 2, 2026 by skx56 Loading…
2 tasks done
1
Fix issue 3402: Add overwrite protection to DiskDataset methods
#5077 opened Jul 30, 2026 by rupamkgp Loading…
15 tasks done
1
Add RFDiffusion contig parser and motif scaffolding utilities
#5076 opened Jul 28, 2026 by chidwipak Contributor Loading…
Fix ModularTorchModel.fit_generator ignoring the loss argument
#5075 opened Jul 26, 2026 by ashishsoni-ai Loading…
1
Add RFDiffusion SO(3) rotation diffusion utilities
#5073 opened Jul 25, 2026 by chidwipak Contributor Loading…
OLMo Wrapper Part 2: Added Lora/QLoRA and DDP to OLMo Wrapper and their respective tests
#5071 opened Jul 24, 2026 by priyadp1 Contributor Loading…
7 of 14 tasks
Add HyperoptHyperparamOpt hyperparameter tuner (#2684)
#5070 opened Jul 23, 2026 by uditjainstjis Loading…
7 tasks done
1
Fix misleading restore=False docstring in Model.fit (#1491)
#5069 opened Jul 23, 2026 by uditjainstjis Loading…
6 tasks done
1
Warn when create_dataset is called on a non-empty directory
#5068 opened Jul 23, 2026 by ArneshBanerjee Loading…
1
Numpy 2.0 migration
#5066 opened Jul 22, 2026 by sudo-rsingh Contributor Loading…
12 of 15 tasks
CI fixes for tf-test
#5065 opened Jul 21, 2026 by shubham-bari Contributor • Draft
12 of 15 tasks
fix: correct DTNNEmbedding initializer typo
#5064 opened Jul 20, 2026 by amrit-max Loading…
1
ProTip! Exclude everything labeled bug with -label:bug.