All content

Search filter terms
Filter by category
Filter by type
Filter by tag
Filter by user
Filter by licence
Results per page:
Sort by:
Showing 2 results. Use the filters on the left and the search box below to refine the results.
Category: Workflow Type: Bioclipse Scripting Language Tag: mdl sd file User: Egon Willighagen Licence: by-sa

Workflow Create a molecules table from a list of IU... (1)

Thumb
 Scripts that uses OPSIN to convert IUPAC names into chemical structures, which are saved as SD file and openend in the Bioclipse molecules table.

Created: 2011-05-25 | Last updated: 2011-05-25

Credits: User Egon Willighagen

Workflow Calculate molecular mass for entries in a ... (1)

 Simple script to demonstrate how to iterate over entries in a MDL SD file and calculate some molecular property.

Created: 2010-03-08

Credits: User

Results per page:
Sort by: