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Chemistry 2004 Top Products Award Winner: MacroModel

November 30, 2004 7:00 pm | Schrodinger, Inc. | Product Releases | Comments

MacroModel molecular modeling software includes automatic setup for MCMM calculations in batch mode, serial MCMM calculations and mixed-mode searches with LMOD and LLMOD

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Chemistry 2004 Top Products Award Winner: acslXtreme OPTIMUM

November 30, 2004 7:00 pm | The Aegis Technologies Group, Inc. | Product Releases | Comments

acslXtreme OPTIMUM modeling, execution and analysis environment enhances the pharmacokinetic modeling software, giving drug developers and risk assessors parameter estimation

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SYBYL 7.0

November 30, 2004 7:00 pm | Tripos, Inc. | Product Releases | Comments

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.

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DecisionSite for Lead Discovery

November 30, 2004 7:00 pm | Tibco | Product Releases | Comments

DecisionSite for Lead Discovery is a guided analytic application configured to provide easy access to standard internal and external data repositories.

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MacroModel

November 30, 2004 7:00 pm | Schrodinger, Inc. | Product Releases | Comments

MacroModel molecular modeling software features a large selection of force fields and advanced methods for conformational analysis, molecular dynamics, and free energy calculations.

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ACD-ChemSketch

November 30, 2004 7:00 pm | Advanced Chemistry Development, Inc. | Product Releases | Comments

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.

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MS Modeling 3.0

November 30, 2004 7:00 pm | Accelrys | Product Releases | Comments

MS Modeling is a modeling and simulation software suite, featuring tools for materials property prediction using statistical correlation methods and tools for crystallization modeling.

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Chemistry 2004 Top Products Award Winner: Sequence Detection System

November 30, 2004 7:00 pm | Applied Biosystems | Product Releases | Comments

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

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ChemWindow

November 30, 2004 7:00 pm | Bio-Rad Laboratories | Product Releases | Comments

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.

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ChemOffice Ultra 2005

November 30, 2004 7:00 pm | Cambridgesoft | Product Releases | Comments

ChemOffice Ultra is software for chemical and biological publishing, workstation-quality molecular modeling, and database work.

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Molecular Operating Environment

November 30, 2004 7:00 pm | Chemical Computing Group, Inc. | Product Releases | Comments

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.

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Materials Explorer

November 30, 2004 7:00 pm | Fujitsu America Inc. | Product Releases | Comments

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.

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QShape

November 30, 2004 7:00 pm | Query+, Inc. | Product Releases | Comments

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.

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Computers 2004 Top Products Award Winner: Onyx4 UltimateVision

November 30, 2004 7:00 pm | Sgi | Product Releases | Comments

The Onyx4 UltimateVision visualization system and Tezro rackmount workstation have been coupled with the widescreen ViewSonic display

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Spectroscopy 2004 Top Products Award Winner: SpecManager

November 30, 2004 7:00 pm | Advanced Chemistry Development, Inc. | Product Releases | Comments

SpecManager is an overall spectroscopic processing and analytical data management system that includes a flexible module for visualizing and supporting hyphenated data

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