MATLAB integrates mathematical computing, visualization, and a powerful language to provide a flexible environment for technical computing
FEMLAB multiphysics environment models single and coupled phenomena based on partial differential equations (PDE), which pertain to most science and engineering applications
FlexPDE is a scripted finite element model builder and numerical solver. From a script written by the user, the software performs the operations necessary to turn
Maple is a principal desktop productivity environment used by industry, research organizations and academic institutions
JMP links statistics and graphics. The software integrates visualization into the modeling tools so that users understand the relationships found in their data
MacroModel molecular modeling software features a large selection of force fields and advanced methods for conformational analysis, molecular dynamics, and free energy calculations.
MS Modeling is a modeling and simulation software suite, featuring tools for materials property prediction using statistical correlation methods and tools for crystallization modeling.
ACD/ChemSketch allows users to draw molecules in a chemistry-oriented interface with customizable toolbars. The software provides the ability to work with structures, text, and graphics simultaneously and to transfer to any OLE-supported software, such as MS Office.
KnowItAll's ChemWindow Edition is chemistry publishing software designed for chemists who need to draw chemical structures and publish professional reports with structures, spectra, chromatograms, chemical reactions, lab experiment setups, chemical engineering diagrams and data tables.
acslXtreme OPTIMUM modeling, execution and analysis environment enhances the pharmacokinetic modeling software, giving drug developers and risk assessors parameter estimation
DecisionSite for Lead Discovery is a guided analytic application configured to provide easy access to standard internal and external data repositories.
QShape is a fingerprint that enables scientists to prioritize compounds for screening, focusing tests where they have the highest probability of success, and to understand the properties of new compounds.
ChemOffice Ultra is software for chemical and biological publishing, workstation-quality molecular modeling, and database work.
Materials Explorer is a multi-purpose molecular dynamics package for Windows. Temperature and pressure-controlled molecular dynamics simulations are available by employing the Parrinello-Rahman and Nose methods. A velocity-scaling method is also available for controlled temperatures.
SYBYL 7.0 is a molecular modeling environment for drug discovery research. The software is available on multiple platforms and includes a Linux operating system upgrade, Red Hat Enterprise Linux 3.0.