A quantitative structure–activity relationship (QSAR) study on 43 amide repellents was carried out by the heuristic method in order to reveal the correlations between molecular parameters of these ami
Chemical substance data from PubChem database. This dataset contains comprehensive chemical information including structural data, physical properties, and biological...
This file consists of a workflow of a prediction model for biological activity used in chemoinformatics, it consists of a simple but quite robust map for those who are initiating studies on rational d
This is a database for open-framework aluminophosphate structures. All structures are stored in CIF format. The corresponding structure information for each structure can be found in the attached EXCE