Difference between revisions of "Smallworlds On Abacus"

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Public Smallworld contains these datasets:
 
Public Smallworld contains these datasets:
*July 30, 2020
+
 
**Enamine_REAL_Public_July_2020_Q1-2_1.36B
+
+-------------------------------------------------+-------+
*Old Datasets
+
|Dataset                                          |Size  |
**BB-All-2020Q2-26.7M
+
+-------------------------------------------------+-------+
**BB-Now-2020Q2-1.6M
+
|Enamine_REAL_Public_July_2020_Q1-2_1.36B         |95  GB |
**Enamine-V-2020Q2-1.2B
+
|BB-All-2020Q2-26.7M                             |1.6 GB |
**Enamine-V-M-2020Q2-408M
+
|BB-Now-2020Q2-1.6M                               |109 MB |
**Enamine-V-S-2020Q2-803M
+
|Enamine-V-2020Q2-1.2B                           |96  GB |
**HMDB-2020Q2-584
+
|Enamine-V-M-2020Q2-408M                         |41  GB |
**In-Stock-2020Q2-13.8M
+
|Enamine-V-S-2020Q2-803M                         |58  GB |
**TCNMP-2020Q2-31912
+
|HMDB-2020Q2-584                                 |56  KB |
**Wait-OK-2020Q2-1.2B
+
|In-Stock-2020Q2-13.8M                           |1.1 GB |
**WorldDrugs-2020Q2-3004
+
|TCNMP-2020Q2-31912                               |3.3 MB |
**WuXi-2020Q2-120M
+
|Wait-OK-2020Q2-1.2B                             |89  GB |
**ZINC-All-2020Q2-1.46B
+
|WorldDrugs-2020Q2-3004                           |275 KB |
**ZINC-For-Sale-2020Q2-1.46B
+
|WuXi-2020Q2-120M                                 |12  GB |
**ZINC-Interesting-2020Q2-300K
+
|ZINC-All-2020Q2-1.46B                           |110 GB |
 +
|ZINC-For-Sale-2020Q2-1.46B                       |110 GB |
 +
|ZINC-Interesting-2020Q2-300K                     |30  MB |
 +
+-------------------------------------------------+-------+
  
 
== Private Smallworld ==
 
== Private Smallworld ==
Line 32: Line 35:
  
 
Private Smallworld contains these datasets:
 
Private Smallworld contains these datasets:
*August 03, 2020
+
 
**Enamine_REAL_Space_June_2020_S13.5B
+
+-------------------------------------------------+-------+
*Old Datasets
+
|Dataset                                          |Size  |
**EnaminePrivate-All-19Q2-11.7B.anon.map.cfg
+
+-------------------------------------------------+-------+
**EnaminePrivate-0-400-19Q4-7.8B
+
|Enamine_REAL_Space_June_2020_S13.5B             |
**EnaminePrivate-0-400-19Q4-7.8B
+
|EnaminePrivate-All-19Q2-11.7B                   |
**EnaminePrivate-500-Inf-19Q4
+
|EnaminePrivate-0-400-19Q4-7.8B                   |
**EnaminePrivate-All-19Q2-11.7B
+
|EnaminePrivate-0-400-19Q4-7.8B                   |
**EnaminePrivate0to500-19Q2-11.6B
+
|EnaminePrivate-500-Inf-19Q4                     |
**EnaminePrivate0to500-19Q2-11.6B
+
|EnaminePrivate-All-19Q2-11.7B                   |
**EnamineReal2020-2020Q1-12.2B
+
|EnaminePrivate0to500-19Q2-11.6B                 |
 +
|EnaminePrivate0to500-19Q2-11.6B                 |
 +
|EnamineReal2020-2020Q1-12.2B                     |
 +
+-------------------------------------------------+-------+
  
 
== Super Private Smallworld ==
 
== Super Private Smallworld ==

Revision as of 15:29, 13 August 2020

Introduction

Abacus hosts three smallworld servers. Each server contains different datasets.

1. Public: 10.20.0.5:5020
2. Private: 10.20.0.5:8080
3. Super Private: 10.20.0.5:5099

Public Smallworld

Location: /mnt/nfs/db2/public_smallworld/maps

Public Smallworld contains these datasets:

+-------------------------------------------------+-------+
|Dataset                                          |Size   |
+-------------------------------------------------+-------+
|Enamine_REAL_Public_July_2020_Q1-2_1.36B         |95  GB |
|BB-All-2020Q2-26.7M                              |1.6 GB |
|BB-Now-2020Q2-1.6M                               |109 MB |
|Enamine-V-2020Q2-1.2B                            |96  GB |
|Enamine-V-M-2020Q2-408M                          |41  GB |
|Enamine-V-S-2020Q2-803M                          |58  GB |
|HMDB-2020Q2-584                                  |56  KB |
|In-Stock-2020Q2-13.8M                            |1.1 GB |
|TCNMP-2020Q2-31912                               |3.3 MB |
|Wait-OK-2020Q2-1.2B                              |89  GB |
|WorldDrugs-2020Q2-3004                           |275 KB |
|WuXi-2020Q2-120M                                 |12  GB |
|ZINC-All-2020Q2-1.46B                            |110 GB |
|ZINC-For-Sale-2020Q2-1.46B                       |110 GB |
|ZINC-Interesting-2020Q2-300K                     |30  MB |
+-------------------------------------------------+-------+

Private Smallworld

Location: /mnt/nfs/db2/private_smallworld/maps

Private Smallworld contains these datasets:

+-------------------------------------------------+-------+
|Dataset                                          |Size   |
+-------------------------------------------------+-------+
|Enamine_REAL_Space_June_2020_S13.5B              |
|EnaminePrivate-All-19Q2-11.7B                    |
|EnaminePrivate-0-400-19Q4-7.8B                   |
|EnaminePrivate-0-400-19Q4-7.8B                   |
|EnaminePrivate-500-Inf-19Q4                      |
|EnaminePrivate-All-19Q2-11.7B                    |
|EnaminePrivate0to500-19Q2-11.6B                  |
|EnaminePrivate0to500-19Q2-11.6B                  |
|EnamineReal2020-2020Q1-12.2B                     |
+-------------------------------------------------+-------+

Super Private Smallworld

Location: /mnt/nfs/db2/super_private_smallworld/maps

***Contains all Datasets from Private and Public***

  • Unique Datasets
    • EnaminePrivate-0-500-19Q4-16.3B
    • EnaminePrivate-All-19Q4-16.5B