Hugging Face's logo

Datasets:
Fangyinfff
/
molecules

Tasks:
Other
License:
Dataset card Files
xet
 Community
Fangyinfff commited on
Commit
daaa2a0
·
verified ·
1 Parent(s): e705b5c

Add files using upload-large-folder tool

Browse files
This view is limited to 50 files because it contains too many changes.   See raw diff
Files changed (50) hide show
  1. zinc3d/CH/AAHL/CHAAHL.xaa.sdf.gz +3 -0
  2. zinc3d/CH/AAHM/CHAAHM.xaa.sdf.gz +3 -0
  3. zinc3d/CH/AAHN/CHAAHN.xaa.sdf.gz +3 -0
  4. zinc3d/CH/AAHO/CHAAHO.xaa.sdf.gz +3 -0
  5. zinc3d/CH/AALM/CHAALM.xaa.sdf.gz +3 -0
  6. zinc3d/CH/AALN/CHAALN.xaa.sdf.gz +3 -0
  7. zinc3d/CH/AALO/CHAALO.xaa.sdf.gz +3 -0
  8. zinc3d/CH/AALP/CHAALP.xaa.sdf.gz +3 -0
  9. zinc3d/CH/AAML/CHAAML.xaa.sdf.gz +3 -0
  10. zinc3d/CH/AAMM/CHAAMM.xaa.sdf.gz +3 -0
  11. zinc3d/CH/AAMN/CHAAMN.xaa.sdf.gz +3 -0
  12. zinc3d/CH/AAMO/CHAAMO.xaa.sdf.gz +3 -0
  13. zinc3d/CH/AAMP/CHAAMP.xaa.sdf.gz +3 -0
  14. zinc3d/CH/AARL/CHAARL.xaa.sdf.gz +3 -0
  15. zinc3d/CH/AARM/CHAARM.xaa.sdf.gz +3 -0
  16. zinc3d/CH/AARN/CHAARN.xaa.sdf.gz +3 -0
  17. zinc3d/CH/AARO/CHAARO.xaa.sdf.gz +3 -0
  18. zinc3d/CH/AARP/CHAARP.xaa.sdf.gz +3 -0
  19. zinc3d/CH/ABHL/CHABHL.xaa.sdf.gz +3 -0
  20. zinc3d/CH/ABHM/CHABHM.xaa.sdf.gz +3 -0
  21. zinc3d/CH/ABHN/CHABHN.xaa.sdf.gz +3 -0
  22. zinc3d/CH/ABHO/CHABHO.xaa.sdf.gz +3 -0
  23. zinc3d/CH/ABLL/CHABLL.xaa.sdf.gz +3 -0
  24. zinc3d/CH/ABLM/CHABLM.xaa.sdf.gz +3 -0
  25. zinc3d/CH/ABLN/CHABLN.xaa.sdf.gz +3 -0
  26. zinc3d/CH/ABLO/CHABLO.xaa.sdf.gz +3 -0
  27. zinc3d/CH/ABLP/CHABLP.xaa.sdf.gz +3 -0
  28. zinc3d/CH/ABML/CHABML.xaa.sdf.gz +3 -0
  29. zinc3d/CH/ABMM/CHABMM.xaa.sdf.gz +3 -0
  30. zinc3d/CH/ABMN/CHABMN.xaa.sdf.gz +3 -0
  31. zinc3d/CH/ABMO/CHABMO.xaa.sdf.gz +3 -0
  32. zinc3d/CH/ABMP/CHABMP.xaa.sdf.gz +3 -0
  33. zinc3d/CH/ABRL/CHABRL.xaa.sdf.gz +3 -0
  34. zinc3d/CH/ABRM/CHABRM.xaa.sdf.gz +3 -0
  35. zinc3d/CH/ABRN/CHABRN.xaa.sdf.gz +3 -0
  36. zinc3d/CH/ABRO/CHABRO.xaa.sdf.gz +3 -0
  37. zinc3d/CH/ABRP/CHABRP.xaa.sdf.gz +3 -0
  38. zinc3d/CH/ACHM/CHACHM.xaa.sdf.gz +3 -0
  39. zinc3d/CH/ACHN/CHACHN.xaa.sdf.gz +3 -0
  40. zinc3d/CH/ACLN/CHACLN.xaa.sdf.gz +3 -0
  41. zinc3d/CH/ACMN/CHACMN.xaa.sdf.gz +3 -0
  42. zinc3d/CH/ACRM/CHACRM.xaa.sdf.gz +3 -0
  43. zinc3d/CH/ACRN/CHACRN.xaa.sdf.gz +3 -0
  44. zinc3d/CH/ACRO/CHACRO.xaa.sdf.gz +3 -0
  45. zinc3d/CH/ADHL/CHADHL.xaa.sdf.gz +3 -0
  46. zinc3d/CH/ADHM/CHADHM.xaa.sdf.gz +3 -0
  47. zinc3d/CH/ADHN/CHADHN.xaa.sdf.gz +3 -0
  48. zinc3d/CH/ADHN/CHADHN.xab.sdf.gz +3 -0
  49. zinc3d/CH/ADHN/CHADHN.xac.sdf.gz +3 -0
  50. zinc3d/CH/ADHO/CHADHO.xaa.sdf.gz +3 -0
zinc3d/CH/AAHL/CHAAHL.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:e6e88740198cec3f3e14683b9f4e2f639d0947538315fcf39aecd8647b6353ca
3
+ size 16098
zinc3d/CH/AAHM/CHAAHM.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:0ac7a49b36862219fab9b54cc5b57f2fb38a8c139f473bc38ad33f1fa30f5bda
3
+ size 351667
zinc3d/CH/AAHN/CHAAHN.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:e98e3fd9819ce9ea507d635abe8cf92e9dd479be083acaa2b10df50546942f95
3
+ size 1354649
zinc3d/CH/AAHO/CHAAHO.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:4ae53d94d3f17f7bce0bcff410069263813f595a7274e7eb9490013bb342b2e1
3
+ size 83103
zinc3d/CH/AALM/CHAALM.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:884267dd9cc2f94df91a9ac219d020ed1596af0f5a5a5b988ac01d7e2f1e868b
3
+ size 1962
zinc3d/CH/AALN/CHAALN.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:ea5433d31ca3daa41adc4c3af9505c762b09aad9051e11a7fe2030fa0bdf52dd
3
+ size 125764
zinc3d/CH/AALO/CHAALO.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:38ad07638107cc519f269ad22b75b86d71e6e0a67e0c679d84f7910b58f8ea86
3
+ size 1033491
zinc3d/CH/AALP/CHAALP.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:d251e8cf7cd92583cd0efc9d198b5ef10681776a424461e43b946cdd0f4db40e
3
+ size 182264
zinc3d/CH/AAML/CHAAML.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:ece8e114048e410c8c051e54bc84da327a87d1feadc7a3d5f5d1352bb50c8fae
3
+ size 5225
zinc3d/CH/AAMM/CHAAMM.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:f14b373eb679f2c300779dd6f8435e049ee1788ec27f269cf880fb9363cc4532
3
+ size 240126
zinc3d/CH/AAMN/CHAAMN.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:4a89a348bb32a8057fbc60a18698dbcc7b0ee9ed635f81a997f32d1e64d4d8ee
3
+ size 1265954
zinc3d/CH/AAMO/CHAAMO.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:c46eb68604cd54fcda755562263c39cf23cb233f1f320338c30713526941ab95
3
+ size 2117552
zinc3d/CH/AAMP/CHAAMP.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:b8135d5d2127ed636380db07e3a83b7ec60800c2860ccaf0683840fc05fe97da
3
+ size 150074
zinc3d/CH/AARL/CHAARL.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:5e33fbb26227bad7796dc7a03834e7233a87ffa54d886ee2cec8e7785e78ed03
3
+ size 14904
zinc3d/CH/AARM/CHAARM.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:4ee4391da2ca1ec63ffe42847caca58a5ec01925200f29bf755f8a636b924848
3
+ size 1156072
zinc3d/CH/AARN/CHAARN.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:4eb0710d1f194460bcce10cd8b2a9caf4156b0a381d2201f6770ed5764f9b63e
3
+ size 26943588
zinc3d/CH/AARO/CHAARO.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:20e64272ca6a2cff0be51ffda675223a676205e7beec83e7bc3c8040c0bfc137
3
+ size 4550464
zinc3d/CH/AARP/CHAARP.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:e4a454524f603456ea27441dfdeae6ab502f40b3545c6dcd3e7e63eaa77afad4
3
+ size 104340
zinc3d/CH/ABHL/CHABHL.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:a30733b001be483d6f3b7cf6e7736fc259c7a7fddbaab36938e2635a9dcc46b4
3
+ size 5485
zinc3d/CH/ABHM/CHABHM.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:63977a34866ec60f46d091aabc159ea1ba69f1e989f0a3a2657af2eb3aec1a68
3
+ size 85338
zinc3d/CH/ABHN/CHABHN.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:22eddb9bea165596a31fea63d1d4b3314bb32489ce37278ffc76753bcf4d0e2c
3
+ size 504714
zinc3d/CH/ABHO/CHABHO.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:9b37d5edb76940e0663cb2e40f4c86cfae8b0788c3fefb7049bfcaaf138d1e85
3
+ size 18800
zinc3d/CH/ABLL/CHABLL.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:4057246baf886d83677284f5e27540eafdda2cd9ce2b26a5a1c2ecaa1567b548
3
+ size 1295
zinc3d/CH/ABLM/CHABLM.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:29aade9872b1942055f83640c9c3824e2ac35afeb77c5118418c6850ede0c51a
3
+ size 598
zinc3d/CH/ABLN/CHABLN.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:733e5281fe9afa992562c7ccbde60d677eff4c1b19a4c0ae3c766326a7183ce4
3
+ size 40600
zinc3d/CH/ABLO/CHABLO.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:9440e9f78abccfaeb0045053d88cd585824a6820b224e3af2f48e5513db1927d
3
+ size 220050
zinc3d/CH/ABLP/CHABLP.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:79fb2536369e199ee07418af94d854c8311607c8285adbf8087a1ff381695029
3
+ size 50652
zinc3d/CH/ABML/CHABML.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:35882932efc28f10ba897276ecc51a5522f1e7fa89cca62400a58c033a1ebfab
3
+ size 1687
zinc3d/CH/ABMM/CHABMM.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:6abde7c11df00915940ffb4b10e0a5b50a9d618dca8028a2714c2ab92d7fb9ff
3
+ size 47548
zinc3d/CH/ABMN/CHABMN.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:df7d75d5a3d0a5038ac431adebc640e7291c4170303d397f9f6c432f6e36ee36
3
+ size 246374
zinc3d/CH/ABMO/CHABMO.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:f0c797ae75ec1c28971ccb129305d7b5567ac2414749a599b55eb179fee9b4de
3
+ size 743615
zinc3d/CH/ABMP/CHABMP.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:ab2c50921ce837c4001913a3502a98c2a29f6624d8767864e17dcd99e7e1e46d
3
+ size 30371
zinc3d/CH/ABRL/CHABRL.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:280666e2ff323f1a2758485c80777473a9b56dc13d69b203289d6c521c13d111
3
+ size 7620
zinc3d/CH/ABRM/CHABRM.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:72eb595df72604df0d17fa6ee49b09eafd148304664a625ab63eb471197587a0
3
+ size 755772
zinc3d/CH/ABRN/CHABRN.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:aa7db419752569e0f7f5c27ea1d9b918ff87ab6d913b850c2b7a3bf371deeec9
3
+ size 7493047
zinc3d/CH/ABRO/CHABRO.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:55dd338bbdb34b6e15e9751c75947c3a4eddf86fd22a33fc9895875c4dd18bea
3
+ size 1551031
zinc3d/CH/ABRP/CHABRP.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:593e9db1d9711789211397bf952071f468f478be5ed470a00e921282b138416a
3
+ size 41704
zinc3d/CH/ACHM/CHACHM.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:900c95da299768ed79acae8d4b213d979a74311ef784b854ce96d80f2bf4fcef
3
+ size 621
zinc3d/CH/ACHN/CHACHN.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:7e8978eeadd5002eee5aa9f36676bb8b5ca2e21d3271692fc741261c237b4f19
3
+ size 1073
zinc3d/CH/ACLN/CHACLN.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:8a269876ad4e7b750a5018ce6d9e3fc9e8cd06d57e6fb3a2d620b2ed7737b60b
3
+ size 1262
zinc3d/CH/ACMN/CHACMN.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:00fa3c34d8235dadeab235c00a9c8f27fb24c5fd13d89a9764549fa63a1a6036
3
+ size 650
zinc3d/CH/ACRM/CHACRM.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:34b72e13842298c0cde56f6862f0295912d73570ce072675b5dbb2fafebf685b
3
+ size 11995
zinc3d/CH/ACRN/CHACRN.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:602e13696e6f6a15ff565acfa03d2affae7479ff8586956a21a1ec66250bc583
3
+ size 23089
zinc3d/CH/ACRO/CHACRO.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:b802fe6d939b522014623c18e4809586983dcd5edd49d6401f145739c06658c8
3
+ size 1107
zinc3d/CH/ADHL/CHADHL.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:a5c43354f5cbab2048f2ca6cb0eca60a5f8af10603d8ebc73c50ac3f55b63be4
3
+ size 105704
zinc3d/CH/ADHM/CHADHM.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:442e12db8c4859bd3166f8c19d7c6e01993a18cfedc9847a74a1529a9a3a9a11
3
+ size 12821005
zinc3d/CH/ADHN/CHADHN.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:e8d4effb8fa365553fab9fd1ebe69073f78c003b1e839173e9a92d80668f3aa4
3
+ size 57426465
zinc3d/CH/ADHN/CHADHN.xab.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:562f2ac8732ec80eb6846a3411d16eeb5feafd09c1d1e0576aba2701da38d4d0
3
+ size 17678176
zinc3d/CH/ADHN/CHADHN.xac.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:9f2ef97eb0b89e9b28c7e7626bf49bbc7290f57db35c9c5389af713da0f0de6a
3
+ size 8942321
zinc3d/CH/ADHO/CHADHO.xaa.sdf.gz ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:7b634e47774e1150199a611f53f8b1e7ff81799670c485792e0d3e0489478568
3
+ size 15354155