Commits · 80f0d617b8d3ec4127a18a94f783d3ed1e12a784 · OpenDAS / OpenFold

28 Jun, 2023 6 commits
- solved cuda error just for now by moving the 2 tensors to cpu · 80f0d617
  Geoffrey Yu authored Jun 28, 2023
  
  80f0d617
- move some tensors back to gpu · 3ab9da6e
  Geoffrey Yu authored Jun 28, 2023
  
  3ab9da6e
- now check the batch_size in compute_tm function · a420160f
  Geoffrey Yu authored Jun 28, 2023
  
  a420160f
- update the compue_tm function · 5e1af36e
  Geoffrey Yu authored Jun 28, 2023
  
  5e1af36e
- added batch_size dimension · c69053e5
  Geoffrey Yu authored Jun 28, 2023
  
  c69053e5
- added batch_size dimesion to compute_tm · 15105078
  Geoffrey Yu authored Jun 28, 2023
  
  15105078
27 Jun, 2023 4 commits
- Update README.md · a3ea7c65
  Dingquan Yu authored Jun 27, 2023
  
  a3ea7c65
- Merge pull request #3 from dingquanyu/modify-assignment-stage · 3d87ef2f
  Dingquan Yu authored Jun 27, 2023
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Modify assignment stage
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  3d87ef2f
- start working on loss part · eeb035c2
  Geoffrey Yu authored Jun 27, 2023
  
  eeb035c2
- remove shuffling · 24e470be
  Geoffrey Yu authored Jun 27, 2023
  
  24e470be
26 Jun, 2023 6 commits
- handel NaN and Inf in test output to avoid crashes · 2a70e080
  Geoffrey Yu authored Jun 26, 2023
  
  2a70e080
- switch optimal alignment method to procustes package · 458a62f7
  Geoffrey Yu authored Jun 26, 2023
  
  458a62f7
- swtich to scipy's kabsch algorithm · 82895ec3
  Geoffrey Yu authored Jun 26, 2023
  
  82895ec3
- update the test input to be A2B3 · 5621ac05
  Geoffrey Yu authored Jun 26, 2023
  
  5621ac05
- update codes · 4666e15e
  Geoffrey Yu authored Jun 26, 2023
  
  4666e15e
- Update README.md · 938782e0
  Dingquan Yu authored Jun 26, 2023
  
  938782e0
24 Jun, 2023 5 commits
- added example label files · a741b42a
  Geoffrey Yu authored Jun 24, 2023
  
  a741b42a
- remove unnecessary extra file · 50abc1a7
  Geoffrey Yu authored Jun 24, 2023
  
  50abc1a7
- Merge pull request #2 from dingquanyu/cleanup-permutation · 697ac82a
  Dingquan Yu authored Jun 24, 2023
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added multi-chain permutation to AlphaFoldMultimerLoss
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  697ac82a
- added multi-chain permutation to AlphaFoldMultimerLoss · a49e4896
  Geoffrey Yu authored Jun 24, 2023
  
  a49e4896
- revert data_utils and remove all the changes in this file · 85cd91f6
  Geoffrey Yu authored Jun 24, 2023
  
  85cd91f6
22 Jun, 2023 6 commits
- update test codes · ab659c39
  Geoffrey Yu authored Jun 22, 2023
  
  ab659c39
- fixed downstream greedy align · 4a66504c
  Geoffrey Yu authored Jun 22, 2023
  
  4a66504c
- now used the new way of selecting anchors · a0f8a057
  Geoffrey Yu authored Jun 22, 2023
  
  a0f8a057
- finished codes for num_sym 1 · 54755901
  Geoffrey Yu authored Jun 22, 2023
  
  54755901
- fixed get_anchor_candidates error · f563944a
  Geoffrey Yu authored Jun 22, 2023
  
  f563944a
- remove recycling dimentions · c6ac105d
  Geoffrey Yu authored Jun 22, 2023
  
  c6ac105d
21 Jun, 2023 3 commits
- update codes · d3b2b265
  Geoffrey Yu authored Jun 21, 2023
  
  d3b2b265
- fixed the assertion errors in get_optimal_transform · d4b6163d
  Geoffrey Yu authored Jun 21, 2023
  
  d4b6163d
- finished working on selecting best anchors. now start working on get_optimal_transform · e3e8a681
  Geoffrey Yu authored Jun 21, 2023
  
  e3e8a681
20 Jun, 2023 1 commit
- start working on permutation · 1008f61d
  Geoffrey Yu authored Jun 20, 2023
  
  1008f61d
17 Jun, 2023 3 commits
- start working on multimer loss · 39830684
  Geoffrey Yu authored Jun 17, 2023
  
  39830684
- Merge remote-tracking branch 'upstream/multimer' into multimer · 56d5e39c
  Geoffrey Yu authored Jun 17, 2023
  
  56d5e39c
- Merge pull request #1 from aqlaboratory/main · 56b86074
  Dingquan Yu authored Jun 17, 2023
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Fix batched finetuning bugs
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  56b86074
15 Jun, 2023 1 commit
- Fix batched finetuning bugs · 55003f16
  Gustaf Ahdritz authored Jun 14, 2023
  
  55003f16
14 Jun, 2023 1 commit
- Added multimer changes for loss functions · 51556d52
  Christina Floristean authored Jun 14, 2023
  
  51556d52
02 Jun, 2023 2 commits
- Merge branch 'main' into multimer · fbfbd808
  Christina Floristean authored Jun 02, 2023
  
  fbfbd808
- Fixed bug in triangle multiplicative update and added early stop recycling. · c1129bef
  Christina Floristean authored Jun 02, 2023
  
  c1129bef
18 May, 2023 2 commits
- Merge pull request #320 from vaclavhanzl/fix-colab-conda-all-together · 103d0370
  Gustaf Ahdritz authored May 18, 2023
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Fix Colab: Install all conda packages together
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  103d0370
- Fix Colab: Install all conda packages together · 410e8294
  Vaclav Hanzl authored May 18, 2023
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Later on the conda setup is likely broken by pip.
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  410e8294