Smallworld Databases

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Introduction

This page will detail the databases on smallworld and arthor.

Smallworld Databases

Tables of the five smallworld instances running on abacus.

sw.docking.org

Database Description
BB-All-2020Q2-26.7M.anon some description
BB-Now-2020Q2-1.6M.anon
ChemSpace-BB-Stock-Mar2022
ChemSpace-SC-Stock-Mar2022
In-Stock-2020Q2-13.8M.anon
Informer-Set-22Q3-4M
Mcule-BB-22Q1-2.1M
Mcule-22Q1-8.7M
Mcule-Full-22Q1-56M
Mcule-V-22Q1-47M
MculeUltimate_20Q2_126M
REAL-Database-22Q1-4.5B
Wait-OK-2020Q2-1.2B.anon
WuXi-20Q4-2.2B
ZINC-All-2020Q2-1.46B.anon
ZINC-Interesting-2020Q2-300K.anon

swp.docking.org

Database Description
el2_22Q1_290K some description
REAL-Space-22Q1-21B
y1-22Q3-57M
zinc22-All

swc.docking.org

Database Description
REAL-UCSF-21Q4-18.5B some description

swbb.docking.org

Database Description
ChemSpace-BB-Stock-Mar2022 some description
BB-All-2020Q2-26.7M.anon
BB-Now-2020Q2-1.6M.anon
Mcule-BB-22Q1-2.1M

swcc.docking.org

Database Description
el2_22Q1_290K some description
Piperazine-22Q3-57M

Arthor Databases

Tables of the arthor instances.

arthor.docking.org

Database Description
BB-10-22Q1 some description
BB-20-22Q1
BB-30-22Q1 some description
BB-40-22Q1
BB-50-22Q1 some description
BB-ForSale-22Q1
BB-InStock-22Q1 some description
ChemSpace-BB-Stock-Mar2022-712K
ChemSpace-SC-Stock-Mar2022-346K some description
HMDBMetabolites-20Q1-585
In-Stock-19Q4-13.8M some description
Informer-Set-22Q3-4M
Mcule-22Q1-8.7M some description
Mcule-V-22Q1-51M
Mcule-BB-22Q1-2.1M some description
Mcule-Full-22Q1-60M
Mcule_ultimate_20Q2-126M some description
REAL-Database-22Q1-00
REAL-Database-22Q1-01 some description
TCNMP-20Q1-37K
Wait-OK-19Q4-1.1B some description
World-Drugs-20Q1-3K
WuXi-19Q4-339M some description
ZINC-All-19Q4-1.4B
ZINC-Interesting-2019Q4-307K some description
ZINC-On-Demand-19Q4-311M
ZINC20-ForSale-22Q1 some description

arthorp.docking.org

Database Description
el2_22Q1 some description
REAL-Space-22Q1-00
REAL-Space-22Q1-01 some description
REAL-Space-22Q1-02
REAL-Space-22Q1-03 some description
REAL-Space-22Q1-04
REAL-Space-22Q1-05 some description
REAL-Space-22Q1-06
REAL-Space-22Q1-07 some description
zinc22-22Q1(H01~H25)

arthorc.docking.org

Database Description
REAL_UCSF_21Q4_S some description
REAL_UCSF_21Q4_M(H15~H25)
REAL_UCSF_21Q4_M(H26~H29) some description
REAL_UCSF_21Q4_M(H30~H35)

arthorbb.docking.org

Database Description BB-10-22Q1 some description
BB-20-22Q1
BB-30-22Q1 some description
BB-40-22Q1
BB-50-22Q1 some description
BB-ForSale-22Q1
BB-InStock-22Q1 some description
ChemSpace-BB-Stock-Mar2022-712K
Mcule-BB-22Q1-2.1M some description

arthorcc.docking.org

Database Description
el2_22Q1 some description