Cluster 7:Libraries: Difference between revisions
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= Chem-Space.com Freedom Space 5.0 = | = Chem-Space.com Freedom Space 5.0 = | ||
* chemspace in stock. | |||
* other chemspace libraries? | |||
== Collections (1+2+3 below) == | == Collections (1+2+3 below) == | ||
{| class="wikitable" | {| class="wikitable" | ||
Revision as of 17:43, 5 May 2026
These are the cluster 7 libraries.
- Last update: Apr 30, 2026
Chem-Space.com Freedom Space 5.0
- chemspace in stock.
- other chemspace libraries?
Collections (1+2+3 below)
| File | Size | mapped | unmapped(arthor) | |
|---|---|---|---|---|
| FS5_H05_29-all.smi | 5.614 B | 5.559 (99.0 %) | 55M (23.2M unique) | 100% enumeration to HAC29 |
| FS5_all.smi | 56??B | 55?? B(99%) | 248M (UNK unique) | from HAC30 and beyond, not all enumerated |
Rule of 5 (1)
| File | Size | mapped | unmapped(arthor) |
|---|---|---|---|
| FS5_Ro5_H05-29.smi | 955M | 921.2 (96%) | 33.8M (14.7M unique) |
| FS5_Ro5_H30-32.smi | 1.728B | 1.48B (85.6%) | 248M (105M unique) |
| FS5_Ro5_H33-34.smi | 1.40B | 855M (61.2%) | 542M (245M unique) |
| FS5_Ro5_H35-38.smi | 920M | 417M (45%) | 503M (242M unique) |
Beyond Rule of 5 (2)
| File | Size | mapped | unmapped->arthor (unique) |
|---|---|---|---|
| FS5_BRo5_H12_29.smi | 75.6M | 73.5M (97.2%) | 2.1M (1M unique) |
| FS5_BRo5_H30_36.smi | 1.45B | 700M (48%) | 749.6M (348M unique) |
| FS5_BRo5_H37_41.smi | 2.43B | 474M (19.5%) | 1.956B (983M unique) |
| FS5_BRo5_H42_60.smi | 1.04B | 70M (6.7%) | 970M (xxxM unique) |
Fvn QQQ (3)
| File | Size | mapped | unmapped(arthor) |
|---|---|---|---|
| FS5_F5fvn_H10_29.smi | 100 B | 90.9B (80.1) | 19.1M (12.5M unique) |
| FS5_F5fvn_H30_34.smi | 10 B | 9B | XXXM. () |
| FS5_F5fvn_H35_39.smi | 1 B | 900M | 1.086B ( 770M unique) |
| FS5_F5fvn_H40_72.smi | 1 B | 900M | 1.201B (955M unique) |
Enamine
Products
| File | Size | mapped | unmapped(arthor) |
|---|---|---|---|
| S_H11_25.smi | 2.150B | 2.149B (99.95%) | 1.13M (306.6K unique) |
| S_H26_29.smi | 1.683B | 1.668M (99.1%) | 15.4M (5.2M unique) |
| S_30_50.smi | 1.786B | 1.647B (92.2%) | 139M (60.0M unique) |
| M_H11_23.smi | ?? B | ??B | 546K (193K unique) |
| M_H24.smi | ?? B | ??B | 2.1M (%unique) |
| M_H25.smi | 1.5?? B | ??B | 10.1M (552K unique) |
| M_H26.smi | 2.5?? B | ??B | 10.1M (552K unique) |
| M_H27.smi | 4?? B | ??B | 10.1M (552K unique) |
| M_H28.smi | 6?? B | ??B | 10.1M (552K unique) |
| M_H29.smi | 10?? B | ??B | 10.1M (552K unique) |
| M_30.smi | 100 B | 90M | 10M |
| M_31.smi | 100 B | 90M | 10M |
| M_32.smi | 100 B | 90M | 10M |
| M_33.smi | 100 B | 90M | 10M |
| M_34.smi | 100 B | 90M | 10M |
| M_35.smi | 100 B | 90M | 10M |
| M_36.smi | 100 B | 90M | 10M |
| M_37.smi | 100 B | 90M | 10M |
| M_38.smi | 100 B | 90M | 10M |
| M_39.smi | 100 B | 90M | 10M |