Software allows scientists to electronically organise and manage hundreds of separate files with chemical structures and reactions, create and compare databases, and group and analyse data
Advanced Chemistry Development releases version 7.0 of its data management system ChemFolder.
This software allows scientists to electronically organise and manage hundreds of separate files with chemical structures and reactions, create and compare databases, group and analyse data using advanced graphical presentation and statistical analysis, and predict chemical properties to help manage their synthetic work effectively. ChemFolder is used to compile user data such as chemical structures, complex reaction schemes, graphical objects, and textual notes into a chemically-intelligent interface to create and manage your own databases.
Users can search through several ChemFolder databases simultaneously to retrieve chemical data through extensive search capabilities such as searching by substructures and structure similarity.
ChemFolder is fully integrated with the chemical drawing package ChemSketch and databasing software including HNMR, CNMR, and SpecManager. Version 7.0 of ChemFolder enables users to manage and store complex chemical transformations such as multi-step synthesis or a metabolic reaction.
Support of multi-step synthesis allows users to organise and search data for the entire synthesis, and each of the individual reactions and components.