Generative Design Floes Documentation
Documentation for Generative Design Floes created by OpenEye Scientific Software, Inc.
Contents:
- Introduction
- Generative Design Floe Tutorials, Hit to Lead
- OpenEye Generative Design Floes - DEV - Documentation
- ESS - Reaction & Reagent Database - Export Synthon Collection (Dev Floe)
- ESS - Unenumerated Search Database - Export Reagent Collection (Dev Floe)
- Focused Library - Core Input
- Focused Library - Molecule Input
- Focused Library - Reagent Join
- Focused Library - Synthon Analogs
- Generative Structure Floe
- Generative Structure Floe - Site selection
- Generative Structure Indexing - Graft Database Generator
- Generative Structure Indexing - MMP Molecule Indexer
- Generative Structure Indexing - MMP Transform Extractor
- Reaction & Reagent Database - Create from BULK SMILES
- Reaction & Reagent Database - Create from Dataset
- Reaction & Reagent Database - Create from ZINC Download
- Reaction & Reagent Database - Directory Listing
- Reaction & Reagent Database - Half Reaction Generator
- Reaction & Reagent Database - Launch Product Enumerations
- Reaction & Reagent Database - Product Enumeration Summary
- Reaction & Reagent Database - Reaction Definition Validator
- Reaction & Reagent Database - Reagent Definition Generator
- Reaction & Reagent Database - Reagent Molecule Classification
- Reaction & Reagent Database - Retrieve Reaction Reagents
- Unenumerated Search Database - Create from Reagent Collection
- Release Notes