JChem Base & Cartridge III: Structure searching in memory and visualizing results - Developer Training

post · 4 years ago
by Tamás Csizmazia (ChemAxon)
JChem Cartridge JChem Base
Continuing our previous webinar on database tasks, in this training we will give an overview about structure search in memory and visualization options. Searches can be performed without database usage, reading the molecules one by one from a molecule file or loading into memory and performing search on the molecules stored in memory. Found hits can be visualized by coloring substructure hits in target molecule and alignment of target molecules according to the query. You can download the source codes in zip file, or simply browse it in our Documentation. Download the slides of the presentation in pdf.