Sommario
Caratteristiche tecniche

Database inclusi

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ChemOffice Pro 2006

ChemOfficePro 2006 disegna qualsiasi struttura chimica, la converte simultaneamente in 3D velocizzando e semplificando qualsiasi lavoro.


 Applicazioni Incluse:

ChemDraw Ultra 10.0
ChemDraw ActiveX/Plugin Pro 10.0
MestReC Std
Chem3D Ultra 10.0
Chem3D ActiveX Pro 10.0
GAMESS Pro 10.0
ChemFinder Pro 10.0
BioDraw Ultra 10.0
E-Notebook Ultra 10.0

Caratteristiche tecniche (W indica caratteristiche disponibili solo per la versione Windows)

ChemDraw

Stereochemistry
Identifies stereocenters using Cahn-Ingold Prelog rules.

Online Menu
(W) Draw a structure or model and immediately get online vendor information ChemACX.Com with the click of a button.

Structure CleanUp
Improves poor drawings. 

Multi-Page Docs
Create multiple page documents and posters within a single ChemDraw file.

Name=Struct/Excel
(W) Generate a ChemDraw structure in MS Excel by typing in systematic chemical names for most substances. 

LabArt
Publication-quality EPS glassware art for use within your ChemDraw documents.

Polymer Draw
Represent and manipulate polymers in ChemDraw.

Atom Numbering
Add sequential numbering indicators to atoms in a structure.

Floating Periodic Table
Element information available at all times with floating periodic table on the desktop.

Floating Character Map
Add special characters from any font instantly to any ChemDraw document.

Structure Perspective Tool
Adjust the perspective of ChemDraw molecules with simple horizontal/vertical mouse movements.

Object Specific Settings
Create drawings with different styles in different parts of the document.

Struct<=>Name
Produce names for many more types of compounds, including charged compounds and salts, highly symmetric structures, many types of inorganic and organometallic compounds, and others.

Improved ChemNMR
Proton NMR spectra have more accurate chemical shifts and splitting patterns, and the predicted spectra are displayed more clearly for both proton and carbon-13 NMR predictions.

Stoichiometry Grid
Automatically track and update stoichiometry data for any user-defined chemical reaction.

BioDraw
Draw biological pathways. 

ChemDraw/Excel
(W) Use Excel to organize and analyze your chemical data.

TLC Plate Tool
Customizable and crescent-shaped spots available from TLC tool for reproduction of TLC plates for inclusion in ChemDraw Documents.

Expand Generic Structure
Generate multiple structures from an "abbreviated" generic structure.

Custom Templates & Nicknames
Ability to create & edit templates & nicknames.

ActiveX Edit in ChemDraw
Edit your document using your installed version of ChemDraw, rather than your ActiveX, providing greater screen real estate for editing, and also access to the full range of ChemDraw capabilities.

Mass & Other Fragmentation Tools
Three fragmentation tools: Mass, Dissociation, & Retrosynthesis.

MDL Molfile
Read and write files in the Molfile format. 

Relative Stereochemistry
Allows specification of relationships between groups of stereocenters smaller than an entire molecule. 

ISIS-style Data SGroups
Data can be attached to objects. 

MS Office Integration
(W) ChemDraw offers full integration via OLE, so you can embed your drawings in any Office document.

Graphic Display & Image
Adds greater detail to on-screen drawings and saved image files. 

New Arrows Tool
Control every aspect of arrows drawn, including arc, length, headstyle, dipole, no-go and more.

Color Faded Shapes
Shapes can now be filled with a faded color.

Terminal Carbon Labeling
Automatic display of atom labels on terminal carbon atoms.

Properties LiveLink
Chemical names, formulas, molecular weights, and other physical properties added to the document are “live”, and will now update automatically as modifications are made to structural diagrams.

Chemical File Format
Reading & writing of chemical file formats including spectra & reactions.

Chemical Warnings
Mouse-over red box to read error description.

Graphical File Formats
Import graphics stored in GIF, TIFF, PNG, JPEG, and BMP formats.

Structure Drawing
Draw chemical structures.



Chem3D

Model Explorer/Chem3D
(W) Hierarchical tree-control for exploring the structure of large models. Import a PDB file and examine chains, groups, and ligands. This new feature gives fine-grained control.

GAMESS Interface
(W) Chem3D interface to GAMESS. (Note: GAMESS application is required. See applications included section to clarify.)

Partial Surfaces
(W) Generate and display partial surfaces for protein active sites.

Spectrum Viewer
(W) Display spectral calculation results from Jaguar, Gaussian, and GAMESS as a graphical display in a separate window.

Schrödinger Jaguar Interface
(W) Chem3D interface to Schrödinger Jaguar, an ab-initio calculation package. (Note: Jaguar application is required. See applications included section to clarify.)

Hydrogen Bonds
(W) Automatically display hydrogen bonds in the 3D view!

PowerPoint
(W) Embed Chem3D models in PowerPoint files. Rotate and zoom Chem3D models while giving a presentation.

Group Labels
(W) Display group labels in the Chem3D model view. 

MOPAC Interface
(W) Chem3D interface to MOPAC. (Note: MOPAC application is required. See applications included section to clarify.)

ChemDraw LiveLink
(W) Simultaneous 2D & 3D editing! Draw structures using a ChemDraw window embedded in the Chem3D application. This powerful feature adds a 2D view that is always in-sync with the 3D view.

Dihedral Driver
(W) New conformational analysis tool allows the generation of MM2 energy plots.

Stereo Hardware Support
(W) Use Chem3D with a variety of stereo monitors, shutterglasses, & other hardware to provide a true 3-dimentional modeling experience.

MM
(W) Built in support for MM2 to generate realistic 3D structures.

Molecular Modeling & Dynamics
(W) Workstation quality molecular modeling.

Enhanced Graphics
(W) Chem3D uses openGL to provide high quality graphics display.

3D Glasses
(W) Included glasses provide enhanced stereo-mode with depth shadings to give realistic 3-dimensional quality to all Chem3D renderings. (Included in CD-ROM purchases only.)

Automatic Overlay
(W) Select multiple molecules and let Chem3D automatically align them with a target molecule.

CLogP
(W) CLogP property server provides the latest methodology for calculationg n-octanol/water partition coefficients.

ChemProp/Chem3D
(W) Advanced property parameter including BP, MP and more.

 

ChemFinder

ChemFinder/Office
(W) Search on your computer or network for chemical structures in Word, Excel, Powerpoint, ChemDraw, ISIS files and more, and browse, search, refine, or export your hit list to any destination.

 

E-Notebook Desktop

Microsoft Office & Galactic Spectra / E-Notebook
(W) E-Notebook manages all the other kinds of data chemists store in their notebooks. For free-form data, you can include Microsoft Word or Excel documents. For spectral data, you can take advantage of the Galactic Spectral Control embedded in the notebook that allows for analysis and storage of hundreds of kinds of spectra files. 

ChemDraw & Stoichiometry Calculations / E-Notebook
(W) Stoichiometric calculations are long and tedious. E-Notebook tackles this troublesome problem by performing the calculations for you, dependant upon the drawn reaction and other entered parameters.

Extensive Data Types / E-Notebook
(W) Notebook pages include ChemDraw reaction schemes, Microsoft Word and Excel documents, and spectral data using the Galactic Spectral Control.

AutoText / E-Notebook
(W) Share prewritten protocols that dynamically add data from the experiment.

Configurability / E-Notebook
(W) Design forms and add buttons that are tailored to your needs. (multiple-user configuration only)

Multiple Projects
E-Notebook combines all your notebooks into one. Organize project notebooks the way you work.

Document Pages
Pages contain Excel spreadsheets, Word documents, ChemDraw drawings, spectral data, images and PowerPoint slides.

Retrieval
Search by structure, keyword, dates and other types of data.

BioDraw

Rotation & Integration
Rotate BioDraw objects and combine them with chemical structures.

Pathway Diagrams / BioDraw
BioDraw includes drawing tools specifically designed for pathway diagrams; you can create beautiful pathway diagrams in a matter of minutes.

Integration / BioDra
BioDraw works seamlessly with your other desktop programs so you can use your pathways in presentations and publications.

BioArt
A ChemDraw palette of customizable common biochemistry symbols including membranes, cellular structures and more. 

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Database inclusi (solo Windows)
ChemINDEX ultra 10
Box Edition comes with - (W) 1 DVD with 3 Databases: ChemINDEX (small molecule physical property data 70,000+ compounds), ChemRXN (29,000+ organic reaction databases), NCI Database (200,000+ anti-cancer drug dose-response data), AIDS Database (NCI compiled for anti-viral compounds)
Subscription Edition comes with - (W/M) Online one-year subscription to ChemINDEX

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Requisiti di Sistema
Win 2000 SP4 o Win XP.



Prodotti Correlati
Consulta i prodotti che possono aiutarti ad utilizzare al meglio ChemOffice Pro 2006.

CIS
Conformer
NamExpert
Nomenclator
Tapp
Sciglass
SciPolimer
SciProtein
Spectral Atlas
ScilogP
SciQsar
ChIM
Crystal maker
DOE Fusion
ChemSynth
ChemReact




Top reason for upgrade

1 - New Versions: The new ChemOffice suite includes ChemDraw Ultra 10.0, Chem3D Ultra 10.0, ChemFinder Ultra 10.0, E-Notebook Ultra 10.0, and the ChemInfo 10.0 databases. All these applications offer many compelling and complimentary new features. ChemOffice Ultra 10.0 also includes the new Inventory Ultra and BioAssay Ultra applications, to provide you with the ultimate scientific software suite.

2 - Data visualization with BioViz: ChemFinder 10.0 features much improved data plotting and visualization integrated with your structure and data repositories, so you can analyze data, see trends at a glance, and evaluate diversity among compounds in a library. Plot styles include scatter plots, line charts, and histograms, with list coloring, point filtering, and more.

3 - Inventory Ultra 10: Using MSDE as the database, users are given the opportunity to organize, store, and search over their inventory from their desktop. Includes the ChemACX available chemicals Database, providing a complete tool for research chemical sourcing and purchasing. This a full-featured, industrial-strength inventory system built on top-of-the-line database technology, compatible with CS's enterprise Inventory system, yet designed for individual and workgroup use

4 - Chem3D has more and better visual effects include live Powerpoint integration making it the top-flight presentation tool. All new interfaces to Gaussian and GAMESS, and now for the first time Jaguar support!

5 - Oracle support: ChemFinder 10 comes with the improved ChemFinder/Oracle Cartridge connection, so you get the security and horsepower of Oracle along with the outstanding chemical database handling you've come to expect from ChemFinder.

6 - Electronic Notebook pages now include history,  and have enhanced searching capabilities and improved reaction sections.

7 - BioAssay Ultra 10: This application provides the desktop data storage and modeling needs of both high and low throughput screening biologists.

8 - ChemNMR Improvements: Proton NMR spectra have more accurate chemical shifts and splitting patterns, and the predicted spectra display more clearly for both Proton and Carbon-13 NMR predictions.

9 - Integrated BioDraw: ChemDraw now offers integrated BioDraw for high-quality biological pathway drawing

10 - Stiochiometry:  ChemDraw has a new stoichiometry tool, allowing you to automatically generate a table of reaction stoichiometry, customize the display, change units and toggle visibility of specific information. Tabular data is automatically updated as you draw.