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  1. .gitattributes +400 -0
  2. 4AA_sims_implicit/ADPG/ADPG.xtc +3 -0
  3. 4AA_sims_implicit/ADRR/ADRR.xtc +3 -0
  4. 4AA_sims_implicit/AFMV/AFMV.xtc +3 -0
  5. 4AA_sims_implicit/AGRQ/AGRQ.xtc +3 -0
  6. 4AA_sims_implicit/AGTK/AGTK.xtc +3 -0
  7. 4AA_sims_implicit/AIKI/AIKI.xtc +3 -0
  8. 4AA_sims_implicit/AILP/AILP.xtc +3 -0
  9. 4AA_sims_implicit/ALWP/ALWP.xtc +3 -0
  10. 4AA_sims_implicit/AQAI/AQAI.xtc +3 -0
  11. 4AA_sims_implicit/ARSK/ARSK.xtc +3 -0
  12. 4AA_sims_implicit/ATLM/ATLM.xtc +3 -0
  13. 4AA_sims_implicit/AVAV/AVAV.xtc +3 -0
  14. 4AA_sims_implicit/AVEG/AVEG.xtc +3 -0
  15. 4AA_sims_implicit/AWKW/AWKW.xtc +3 -0
  16. 4AA_sims_implicit/AWQH/AWQH.xtc +3 -0
  17. 4AA_sims_implicit/AYAG/AYAG.xtc +3 -0
  18. 4AA_sims_implicit/AYPG/AYPG.xtc +3 -0
  19. 4AA_sims_implicit/CACS/CACS.xtc +3 -0
  20. 4AA_sims_implicit/CCHV/CCHV.xtc +3 -0
  21. 4AA_sims_implicit/CCLC/CCLC.xtc +3 -0
  22. 4AA_sims_implicit/CDFW/CDFW.xtc +3 -0
  23. 4AA_sims_implicit/CDHM/CDHM.xtc +3 -0
  24. 4AA_sims_implicit/CGMH/CGMH.xtc +3 -0
  25. 4AA_sims_implicit/CKVK/CKVK.xtc +3 -0
  26. 4AA_sims_implicit/CMVY/CMVY.xtc +3 -0
  27. 4AA_sims_implicit/CMWP/CMWP.xtc +3 -0
  28. 4AA_sims_implicit/CPCR/CPCR.xtc +3 -0
  29. 4AA_sims_implicit/CSCE/CSCE.xtc +3 -0
  30. 4AA_sims_implicit/CSFY/CSFY.xtc +3 -0
  31. 4AA_sims_implicit/CSHN/CSHN.xtc +3 -0
  32. 4AA_sims_implicit/CVES/CVES.xtc +3 -0
  33. 4AA_sims_implicit/CWMM/CWMM.xtc +3 -0
  34. 4AA_sims_implicit/CYIT/CYIT.xtc +3 -0
  35. 4AA_sims_implicit/DARI/DARI.xtc +3 -0
  36. 4AA_sims_implicit/DAYV/DAYV.xtc +3 -0
  37. 4AA_sims_implicit/DCDT/DCDT.xtc +3 -0
  38. 4AA_sims_implicit/DCMI/DCMI.xtc +3 -0
  39. 4AA_sims_implicit/DDAG/DDAG.xtc +3 -0
  40. 4AA_sims_implicit/DGDL/DGDL.xtc +3 -0
  41. 4AA_sims_implicit/DGNC/DGNC.xtc +3 -0
  42. 4AA_sims_implicit/DHNR/DHNR.xtc +3 -0
  43. 4AA_sims_implicit/DIMC/DIMC.xtc +3 -0
  44. 4AA_sims_implicit/DINK/DINK.xtc +3 -0
  45. 4AA_sims_implicit/DIVA/DIVA.xtc +3 -0
  46. 4AA_sims_implicit/DLEF/DLEF.xtc +3 -0
  47. 4AA_sims_implicit/DLFD/DLFD.xtc +3 -0
  48. 4AA_sims_implicit/DLND/DLND.xtc +3 -0
  49. 4AA_sims_implicit/DMMK/DMMK.xtc +3 -0
  50. 4AA_sims_implicit/DQVY/DQVY.xtc +3 -0
.gitattributes CHANGED
@@ -5498,3 +5498,403 @@ saved_model/**/* filter=lfs diff=lfs merge=lfs -text
5498
  4AA_sims_implicit/TLSL/TLSL.xtc filter=lfs diff=lfs merge=lfs -text
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  4AA_sims_implicit/NEAE/NEAE.xtc filter=lfs diff=lfs merge=lfs -text
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  4AA_sims_implicit/HAHG/HAHG.xtc filter=lfs diff=lfs merge=lfs -text
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
5498
  4AA_sims_implicit/TLSL/TLSL.xtc filter=lfs diff=lfs merge=lfs -text
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  4AA_sims_implicit/NEAE/NEAE.xtc filter=lfs diff=lfs merge=lfs -text
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  4AA_sims_implicit/HAHG/HAHG.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/TTWV/TTWV.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/EGKE/EGKE.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/HPNK/HPNK.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/NWIP/NWIP.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/WQRL/WQRL.xtc filter=lfs diff=lfs merge=lfs -text
5520
+ 4AA_sims_implicit/MLSM/MLSM.xtc filter=lfs diff=lfs merge=lfs -text
5521
+ 4AA_sims_implicit/HDHV/HDHV.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/YSST/YSST.xtc filter=lfs diff=lfs merge=lfs -text
5523
+ 4AA_sims_implicit/DCDT/DCDT.xtc filter=lfs diff=lfs merge=lfs -text
5524
+ 4AA_sims_implicit/LPQE/LPQE.xtc filter=lfs diff=lfs merge=lfs -text
5525
+ 4AA_sims_implicit/KHSF/KHSF.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/AGTK/AGTK.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/KFCC/KFCC.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/CCLC/CCLC.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/YRFL/YRFL.xtc filter=lfs diff=lfs merge=lfs -text
5530
+ 4AA_sims_implicit/AYPG/AYPG.xtc filter=lfs diff=lfs merge=lfs -text
5531
+ 4AA_sims_implicit/MNLG/MNLG.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/PPEL/PPEL.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/QTQL/QTQL.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/HSCT/HSCT.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/DGDL/DGDL.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/CSCE/CSCE.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/CPCR/CPCR.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/MKTE/MKTE.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/DVAV/DVAV.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/GWVH/GWVH.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/EKCS/EKCS.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/QYHC/QYHC.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/EQGS/EQGS.xtc filter=lfs diff=lfs merge=lfs -text
5559
+ 4AA_sims_implicit/SFSA/SFSA.xtc filter=lfs diff=lfs merge=lfs -text
5560
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+ 4AA_sims_implicit/EEAD/EEAD.xtc filter=lfs diff=lfs merge=lfs -text
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+ 4AA_sims_implicit/DARI/DARI.xtc filter=lfs diff=lfs merge=lfs -text
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5564
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5565
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5566
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5567
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+ 4AA_sims_implicit/GGHN/GGHN.xtc filter=lfs diff=lfs merge=lfs -text
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5581
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5582
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5583
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5584
+ 4AA_sims_implicit/GVQR/GVQR.xtc filter=lfs diff=lfs merge=lfs -text
5585
+ 4AA_sims_implicit/VVYE/VVYE.xtc filter=lfs diff=lfs merge=lfs -text
5586
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5587
+ 4AA_sims_implicit/KRHR/KRHR.xtc filter=lfs diff=lfs merge=lfs -text
5588
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5590
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5591
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5592
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5593
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5594
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5595
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5596
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5597
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5598
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5599
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5601
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5604
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5605
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5610
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5611
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5612
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5613
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5614
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5615
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5616
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5617
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5618
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5619
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5620
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5621
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5622
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5623
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5624
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5625
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5626
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5627
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5629
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5630
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5631
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5643
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5644
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5645
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5646
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5647
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5648
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5649
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5650
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5652
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5653
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5654
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5655
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5656
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