MacroModel molecular modeling software includes automatic setup for MCMM calculations in batch mode, serial MCMM calculations and mixed-mode searches with LMOD and LLMOD
The Enterprise edition of Sequence Detection System (SDS) Software is a high-throughput application for storage, organization and analysis of large amounts of gene expression and genotyping data
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.
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.
Origin is an analysis package that offers a suite of data analysis and custom utility development tools
Discovery Studio MedChem Explorer is a pharmacophore modeling and design application that enables chemists to design active compounds for prescreening synthesis candidates using an in silico approach
acslXtreme OPTIMUM modeling, execution and analysis environment enhances the pharmacokinetic modeling software, giving drug developers and risk assessors parameter estimation
SYSTAT provides statisticians and professional researchers with statistical and graphical capabilities and analytical efficiency
ChemOffice Ultra is software for chemical and biological publishing, workstation-quality molecular modeling, and database work.
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.
Molecular Operating Environment (MOE) provides a suite of applications for manipulating and analyzing large collections of compounds. It is a fully integrated suite of computational chemistry, molecular modeling and informatics software for life science applications.
CISPro Global Chemical Inventory System's software framework allows it to operate in regulated and non-regulated environments, or in a combination of both, for an unlimited number of users.
VIDA is a graphical interface designed to visualize, manage and manipulate large sets of molecular information. Built-in chemoinformatics, advanced list manager, spreadsheet and graphing capabilities make it possible to work in real-time on corporate collections of a million structures.