OEDepict Examples

The following table lists the currently available OEDepict TK examples:

Program

Description

depict

Generating 2D coordinates

match2img

Depicting substructure search match

mcsalign2D

Aligning molecules based on MCS

mdlquery2img

Depicting MDL query

mdlreaction2img

Depicting MDL reaction

mol2img

Depicting a single molecule

mols2pdf

Depicting molecules in a multi-page image

mols2img

Depicting molecules in a grid

ringdict2pdf

Denerating 2D ring dictionary report

smartsalign2D

Aligning molecules based on substructure search

viewmdlsearch

Depicting MDL query substructure search hits

Examples: