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ChemDraw ChemDrawUltra 11: Student Editionby CambridgeSoft
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Win
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Ultimate Chemical Drawing & Information Query Suite
ChemDraw Ultra is the structure drawing suite for the serious professional, with advanced prediction tools and full Web integration using the ChemDraw ActiveX/Plugin.
The ChemDraw Ultra suite also includes ChemDraw/Excel, Chem3D Pro and ChemFinder Std.
Benefit:
Create publication quality graphics featuring chemical structures and lab ware elements.
Automatically calculate and update stoichiometry data for chemical reactions.
Draw peptide and nucleotide sequences using single letter codes.
Preview chemical structures in 3D.
Perform dynamic database lookups on structures.
Convert systematic and common chemical names into publication quality structures.
Generate systematic names for chemical structures.
Predict proton and carbon-12 NMR spectra from structures, with splitting patterns and chemical shifts identified and linked to the structures.
Customize ChemDraw with Nicknames, Templates, Hot Keys and Themes.
Applications Included
ChemDraw Ultra 11.0
Chem3D Pro 11.0
ChemFinder Std 11.0
Struct=Name Pro 11.0
ChemNMR Pro 11.0
ChemDraw/Excel Pro 11.0
ChemDraw ActiveX/Plugin Pro 11.0
Chem3D ActiveX Pro 11.0
MestReC Std
Databases Included
ChemINDEX Ultra 10.0 DVD Edition
Applications Features
Chem3D
ChemProp
Advanced property parameter including BP, MP and more.
Dihedral Driver
New conformational analysis tool allows the generation of MM2 energy plots.
Enhanced Graphics
Chem3D uses openGL to provide high quality graphics display.
Group Labels
Display group labels in the Chem3D model view.
Hydrogen Bonds
Automatically display hydrogen bonds in the 3D view!
Kekule / Delocalized Display Mode
Toggle between dashed line and alternating single-double bond representation of delocalized and aromatic bonds.
MM2
Built in support for MM2 to generate realistic 3D structures.
Model Explorer
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.
Molecular Modeling & Dynamics
Workstation quality molecular modeling.
PowerPoint
Embed Chem3D models in PowerPoint files. Rotate and zoom Chem3D models while giving a presentation.
Spectrum Viewer
Display spectral calculation results from Jaguar, Gaussian, and GAMESS as a graphical display in a separate window.
Stereo Hardware SupportApplications Features
Use Chem3D with a variety of stereo monitors, shutterglasses, & other hardware to provide a true 3-dimentional modeling experience.
ChemDraw
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.
Annotations
Store annotations to include additional reference data for each structure or object in your drawing. Annotation data ranges from manually entered text to attached documents, literature references or links.
Atom Numbering
Add sequential numbering indicators to atoms in a structure.
Chem3D LiveLink
See what structures look like in 3D in a floating window and open Chem3D with a single click from within ChemDraw.
ChemDraw/Excel
Use Excel to organize and analyze your chemical data.
Chemical File Format
Reading & writing of chemical file formats including spectra & reactions.
Chemical Warnings
Mouse-over red box to read error description.
CLogP
CLogP/CMR provides the latest methodology for calculationg n-octanol/water partition coefficients and molar refractivity.
Color Faded Shapes
Shapes can now be filled with a faded color.
Custom Templates & Nicknames
Ability to create & edit templates & nicknames.
Database LiveLink
Search CambridgeSoft databases for chemical structures in real time as you draw.
Expand Generic Structure
Generate multiple structures from an "abbreviated" generic structure.
Floating Character Map
Add special characters from any font instantly to any ChemDraw document.
Floating Periodic Table
Element information available at all times with floating periodic table on the desktop.
Freehand Drawing Tool
Use the mouse or other pointing device to draw freehand shapes using this intuitive drawing tool.
Graphic Display & Image
Adds greater detail to on-screen drawings and saved image files.
Graphical File Formats
Import graphics stored in GIF, TIFF, PNG, JPEG, and BMP formats.
I/Draw Mode
New compatibility mode allows ChemDraw to look and feel like your legacy drawing package.
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.
Improved Molecule Clean-up
A completely revised molecule clean up tool rearranges structures in a more consistent way across a wider spectrum of structure types.
ISIS-style Data SGroups
Data can be attached to objects.
LabArt
Publication-quality EPS glassware art for use within your ChemDraw documents.
Mass & Other Fragmentation Tools
Three fragmentation tools: Mass, Dissociation, & Retrosynthesis.
MDL Molfile
Read and write files in the Molfile format.
MS Office Integration
ChemDraw offers full integration via OLE, so you can embed your drawings in any Office document.
Multi-Page Docs
Create multiple page documents and posters within a single ChemDraw file.
Name=Struct/Excel
Generate a ChemDraw structure in MS Excel by typing in systematic chemical names for most substances.
New Arrows Tool
Control every aspect of arrows drawn, including arc, length, headstyle, dipole, no-go and more.
Object Specific Settings
Create drawings with different styles in different parts of the document.
Online Menu
Draw a structure or model and immediately get online vendor information ChemACX.Com with the click of a button.
Polymer Draw
Represent and manipulate polymers in ChemDraw.
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.
Relative Stereochemistry
Allows specification of relationships between groups of stereocenters smaller than an entire molecule.
SD File Format Support
Import and export SD files directly from ChemDraw.
Sequence Tool
Draw peptide or nucleotide sequences using using 1 and 3 letter codes. The atoms are labeled with amino acid or nucleotide nicknames. The sequences can be expanded and contracted.
Stereochemistry
Identifies stereocenters using Cahn-Ingold Prelog rules.
Stoichiometry Grid
Automatically track and update stoichiometry data for any user-defined chemical reaction.
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.
Structure CleanUp
Improves poor drawings.
Structure Drawing
Draw chemical structures.
Structure Perspective Tool
Adjust the perspective of ChemDraw molecules with simple horizontal/vertical mouse movements.
Terminal Carbon Labeling
Automatic display of atom labels on terminal carbon atoms.
TLC Plate Tool
Customizable and crescent-shaped spots available from TLC tool for reproduction of TLC plates for inclusion in ChemDraw Documents.
tPSA
Topological Polar Surface Area (tPSA) provides a fast approximation of the molecular polar surface area, a useful parameter for prediction of drug transport properties, which has been show to correlate with human intestinal absorption and blood-brain barrier penetration.
ChemFinder
ActiveX Control Boxes
Include third party ActiveX controls on your ChemFinder form.
Automatic Form Generation
Automatically build or extend databases by importing structures from collections of structure files, databases, SDFiles, or other sources.
CAL Programming
CAL is a simple programming language, accessible to non-programmers allows automation, self-running demos, custom operations; includes debugging features.
ChemFinder/Office
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.
Chemical Searching
Search for (sub)structure, similarity, numeric values, text, chemical formula (including element ranges, element exclusions), date. Support for tautomers and alt groups.
Hit List and Query Management
Use a navigation tree to track history of searches between sessions, allow queries to be rerun or reconstituted; merge lists by drag-and-drop in tree. Queries color-coded to relate to BioViz plots.
List Merge
Merge hitlists with any logic: intersect, union, subtract, reverse subtract.
Multiple Data Views
View records one at a time, in a table view or a multiform view.
Subforms
Link relational data to your main table via subforms.
Tabbed Forms
Partition a form into sections using tabbed form pages.
ChemFinder
ActiveX Control Boxes
Include third party ActiveX controls on your ChemFinder form.
Automatic Form Generation
Automatically build or extend databases by importing structures from collections of structure files, databases, SDFiles, or other sources.
CAL Programming
CAL is a simple programming language, accessible to non-programmers allows automation, self-running demos, custom operations; includes debugging features.
ChemFinder/Office
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.
Chemical Searching
Search for (sub)structure, similarity, numeric values, text, chemical formula (including element ranges, element exclusions), date. Support for tautomers and alt groups.
Hit List and Query Management
Use a navigation tree to track history of searches between sessions, allow queries to be rerun or reconstituted; merge lists by drag-and-drop in tree. Queries color-coded to relate to BioViz plots.
List Merge
Merge hitlists with any logic: intersect, union, subtract, reverse subtract.
Multiple Data Views
View records one at a time, in a table view or a multiform view.
Subforms
Link relational data to your main table via subforms.
Tabbed Forms
Partition a form into sections using tabbed form pages.
System Requirements
Windows Windows 2000, XP, Vista (32-bit only); Excel add-ins require MS Excel 2000, 2003, or XP
Macintosh Mac OS X 10.3.x PowerPC, 10.4.x PowerPC, 10.4.x Intel
ChemDraw Ultra is the structure drawing suite for the serious professional, with advanced prediction tools and full Web integration using the ChemDraw ActiveX/Plugin.
The ChemDraw Ultra suite also includes ChemDraw/Excel, Chem3D Pro and ChemFinder Std.
Benefit:
Applications Included
Databases Included
Applications Features
Chem3D
Advanced property parameter including BP, MP and more.
New conformational analysis tool allows the generation of MM2 energy plots.
Chem3D uses openGL to provide high quality graphics display.
Display group labels in the Chem3D model view.
Automatically display hydrogen bonds in the 3D view!
Toggle between dashed line and alternating single-double bond representation of delocalized and aromatic bonds.
Built in support for MM2 to generate realistic 3D structures.
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.
Workstation quality molecular modeling.
Embed Chem3D models in PowerPoint files. Rotate and zoom Chem3D models while giving a presentation.
Display spectral calculation results from Jaguar, Gaussian, and GAMESS as a graphical display in a separate window.
Use Chem3D with a variety of stereo monitors, shutterglasses, & other hardware to provide a true 3-dimentional modeling experience.
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.
Store annotations to include additional reference data for each structure or object in your drawing. Annotation data ranges from manually entered text to attached documents, literature references or links.
Add sequential numbering indicators to atoms in a structure.
See what structures look like in 3D in a floating window and open Chem3D with a single click from within ChemDraw.
Use Excel to organize and analyze your chemical data.
Reading & writing of chemical file formats including spectra & reactions.
Mouse-over red box to read error description.
CLogP/CMR provides the latest methodology for calculationg n-octanol/water partition coefficients and molar refractivity.
Shapes can now be filled with a faded color.
Ability to create & edit templates & nicknames.
Search CambridgeSoft databases for chemical structures in real time as you draw.
Generate multiple structures from an "abbreviated" generic structure.
Add special characters from any font instantly to any ChemDraw document.
Element information available at all times with floating periodic table on the desktop.
Use the mouse or other pointing device to draw freehand shapes using this intuitive drawing tool.
Adds greater detail to on-screen drawings and saved image files.
Import graphics stored in GIF, TIFF, PNG, JPEG, and BMP formats.
New compatibility mode allows ChemDraw to look and feel like your legacy drawing package.
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.
A completely revised molecule clean up tool rearranges structures in a more consistent way across a wider spectrum of structure types.
Data can be attached to objects.
Publication-quality EPS glassware art for use within your ChemDraw documents.
Three fragmentation tools: Mass, Dissociation, & Retrosynthesis.
Read and write files in the Molfile format.
ChemDraw offers full integration via OLE, so you can embed your drawings in any Office document.
Create multiple page documents and posters within a single ChemDraw file.
Generate a ChemDraw structure in MS Excel by typing in systematic chemical names for most substances.
Control every aspect of arrows drawn, including arc, length, headstyle, dipole, no-go and more.
Create drawings with different styles in different parts of the document.
Draw a structure or model and immediately get online vendor information ChemACX.Com with the click of a button.
Represent and manipulate polymers in ChemDraw.
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.
Allows specification of relationships between groups of stereocenters smaller than an entire molecule.
Import and export SD files directly from ChemDraw.
Draw peptide or nucleotide sequences using using 1 and 3 letter codes. The atoms are labeled with amino acid or nucleotide nicknames. The sequences can be expanded and contracted.
Identifies stereocenters using Cahn-Ingold Prelog rules.
Automatically track and update stoichiometry data for any user-defined chemical reaction.
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.
Improves poor drawings.
Draw chemical structures.
Adjust the perspective of ChemDraw molecules with simple horizontal/vertical mouse movements.
Automatic display of atom labels on terminal carbon atoms.
Customizable and crescent-shaped spots available from TLC tool for reproduction of TLC plates for inclusion in ChemDraw Documents.
Topological Polar Surface Area (tPSA) provides a fast approximation of the molecular polar surface area, a useful parameter for prediction of drug transport properties, which has been show to correlate with human intestinal absorption and blood-brain barrier penetration.
ChemFinder
Include third party ActiveX controls on your ChemFinder form.
Automatically build or extend databases by importing structures from collections of structure files, databases, SDFiles, or other sources.
CAL is a simple programming language, accessible to non-programmers allows automation, self-running demos, custom operations; includes debugging features.
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.
Search for (sub)structure, similarity, numeric values, text, chemical formula (including element ranges, element exclusions), date. Support for tautomers and alt groups.
Use a navigation tree to track history of searches between sessions, allow queries to be rerun or reconstituted; merge lists by drag-and-drop in tree. Queries color-coded to relate to BioViz plots.
Merge hitlists with any logic: intersect, union, subtract, reverse subtract.
View records one at a time, in a table view or a multiform view.
Link relational data to your main table via subforms.
Partition a form into sections using tabbed form pages.
ChemFinder
Include third party ActiveX controls on your ChemFinder form.
Automatically build or extend databases by importing structures from collections of structure files, databases, SDFiles, or other sources.
CAL is a simple programming language, accessible to non-programmers allows automation, self-running demos, custom operations; includes debugging features.
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.
Search for (sub)structure, similarity, numeric values, text, chemical formula (including element ranges, element exclusions), date. Support for tautomers and alt groups.
Use a navigation tree to track history of searches between sessions, allow queries to be rerun or reconstituted; merge lists by drag-and-drop in tree. Queries color-coded to relate to BioViz plots.
Merge hitlists with any logic: intersect, union, subtract, reverse subtract.
View records one at a time, in a table view or a multiform view.
Link relational data to your main table via subforms.
Partition a form into sections using tabbed form pages.
System Requirements
Windows Windows 2000, XP, Vista (32-bit only); Excel add-ins require MS Excel 2000, 2003, or XP
Macintosh Mac OS X 10.3.x PowerPC, 10.4.x PowerPC, 10.4.x Intel