Database

D4M

D4M attempts to combine the advantages of five distinct processing technologies (sparse linear algebra, associative arrays, fuzzy algebra, distributed arrays, and triple-store/NoSQL databases such as Hadoop HBase and Apache Accumulo) to provide a database and computation system that addresses the problems associated with Big Data. 

ACD/Labs

ACD/Labs is a chemistry software package used widely to assist academic researchers in identifying chemical compounds. The software consists of an easy-to-use chemical structure drawing interface along with the industry standard systematic naming tools, PhysChem, and NMR prediction software. It also include an aldrich FT NMR spectra database for over 11,000 chemical compounds.

Tripos Sybyl

The SYBYL expert molecular modeling environment provides the fundamental components for understanding molecular structure and properties with special focus on the creation of new chemical entities.