Repository revision
Select a revision to inspect and download versions of Galaxy utilities from this repository.

Repository natural_product_likeness
Name: natural_product_likeness
Owner: bgruening
Synopsis: NP-Likeness calculates natural product-likeness of small molecules based on open-data of natural products
Calculates Natural Product(NP)-likeness of a molecule, i.e. the similarity of the molecule to the structure space covered by known natural products. 
NP-likeness is a useful criterion to screen compound libraries and to design new lead compounds.
Content homepage: https://sourceforge.net/projects/np-likeness/
Development repository: https://github.com/CS76/NP-Likeness
Link to this repository revision: https://toolshed.g2.bx.psu.edu/view/bgruening/natural_product_likeness/b2cad51889ea
Clone this repository: hg clone https://toolshed.g2.bx.psu.edu/repos/bgruening/natural_product_likeness
Type: unrestricted
Revision: 0:b2cad51889ea
This revision can be installed: True
Times cloned / installed: 795
Dependencies of this repository

Repository dependencies - This requires the Molecule datatype definitions (e.g. SMILES, InChI, SD-format).
Repository package_openbabel_2_3 revision ae369c08a2a7 owned by iuc
Repository package_eigen_3_1 revision baedf7f82cc3 owned by iuc (prior install required)
Repository package_cmake_3_2_3 revision 1aea698a1c63 owned by iuc (prior install required)

Tool dependencies - repository tools require handling of these dependencies
Name Version Type
np-likeness-scorer 2.0 package

Contents of this repository

Valid tools - click the name to preview the tool and use the pop-up menu to inspect all metadata
Name Description Version Minimum Galaxy Version
likeness calculator 0.2.1 any

Categories
Computational chemistry - Tools for use in computational chemistry