Type of calculation
Similarity Searching
Algorithm:

Resource id #19
Resource id #23


Select query molecule:
Upload Ligand (mol2, sdf, smi)
Ligand (Smiles)
Draw Ligand
Select target library (optional):
BRUSELAS libraries
DIA-DB DrugBank ChEMBL KEGG
Custom library

Descriptor extraction software:
DRAGON
Select descriptors (optional): A number between 1 and 100 descriptors must be selected.
Distance function:
Manhattan distance Euclidean distance Range values
Compounds related with the following terms:
Consensus scoring function (optional):
Arithmetic mean Weighted arithmetic mean Maximum value
Similarity cutoff [0,1] (optional): Similarity cutoff [0,1] (optional):

Maximum number of hits (optional):

Job description (optional):

Email:


Resource id #25UCAMSENECANLHPCNILSIOANNINON