ZINC15:examples: Difference between revisions

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  catalog.purchasable%20gt%209&ecfp4.data%20similarto%20CC(=O)Oc1ccccc1C(=O)O%20within%20.5?count=all
  catalog.purchasable%20gt%209&ecfp4.data%20similarto%20CC(=O)Oc1ccccc1C(=O)O%20within%20.5?count=all


[[ZINC15:Main entry points]]


= Website Main entry points =
== Browse all compounds in ZINC ==
http://zinc15.docking.org/substances
Variant 1: all in-stock compounds, as SMILES
http://zinc15.docking.org/substances.smi/in-stock
Variant 2: all biogenic building blocks sold by Sigma Aldrich, as an Excel spreadsheet
http://zinc15.docking.org/substances.xlsx?catalog.name=sialbb&catalog.np=1
== Browse all vendors in ZINC ==
http://zinc15.docking.org/catalogs
Variant 1:
http://zinc15.docking.org/catalogs
Variant 2:
http://zinc15.docking.org/catalogs
== Browse all genes in ZINC ==
http://zinc15.docking.org/catalogs
Variant 1: eukaryotic genes
http://zinc15.docking.org/catalogs?organism.name=Eukaryotic
Variant 2: genes for eukaryotic transporters
http://zinc15.docking.org/catalogs?major_class.name='transporter'&organism.type=E
== Browse all target classes in ZINC ==
http://zinc15.docking.org/target_classes
Variant 1: eukaryotic genes
http://zinc15.docking.org/catalogs?organism.name=Eukaryotic
Variant 2: genes for eukaryotic transporters
http://zinc15.docking.org/catalogs?major_class.name='transporter'&organism.type=E
== List options ==
Wait, what are the available major classes?
  http://zinc15.docking.org/majorclasses
And the available organism types?
http://zinc15.docking.org/organisms


Back to [[Webapi]]
Back to [[Webapi]]
[[Category:ZINC15]]
[[Category:ZINC15]]

Revision as of 20:40, 25 March 2015

Examples from the paper

From the abstract

ZINC15:examples:abstract

From the introduction

ZINC15:examples:introduction

From the Results

ZINC15:examples:results-tables

ZINC15:examples:results-figures

ZINC15-examples:results-text


ZINC15 Actions

ZINC15:Actions

orphan

zinc15.docking.org/substances.txt:smiles,zinc_id,tanimoto_similarity? 
catalog.purchasable%20gt%209&ecfp4.data%20similarto%20CC(=O)Oc1ccccc1C(=O)O%20within%20.5?count=all

ZINC15:Main entry points


Back to Webapi

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