ChemBioDraw Ultra 11.0
 This
ultimate Chemistry and Biology drawing and analysis suite includes ChemBioDraw
Ultra 11.0, MestReC Std (W), Chem3D Pro 11.0 (W), ChemFinder Std 11.0 (W),
E-Notebook Pro 11.0 (W), ChemFinder/Office 11.0 (W), the ChemDraw and Chem3D
(W) ActiveX Pro Controls & Plugins, and the ChemInfo (Index, RXN, NCI & AIDS)
Databases (W). ChemBioDraw Ultra 11.0 adds BioDraw, ChemBioViz, and E-Notebook
applications to ChemDraw Ultra 11.0. *(W = Windows Only)
Applications Included
- ChemBioDraw Ultra 11.0
This ultimate chemistry and biology drawing application delivers all
of the industry leading drawing, publishing and analytical features
in ChemDraw combined with the biology features in BioDraw, providing
a complete solution for both chemical structure drawing and analysis
and biological pathway drawing. ChemBioDraw Ultra Chemical structure
analysis tools include 13C and 1H NMR prediction with peak splitting
and highlighting, Struct<=>Name, ChemDraw/Excel, Stoichiometric
analysis., Property predictions Live-Linked to the structure, a Live-Linked
Database Gateway, Fragmentation tools, a TLC plate drawing tool, 3D
structures live-Linked to the 2D structure and more! ChemBioDraw also
offers a number of customization options such as custom Nicknames,
Templates, HotKeys and even newly added ChemBioDraw Themes. Biological
pathway drawing elements include membranes, DNA, enzymes, receptors,
and reaction arrows. tRNA, Ribosomes, Helix Proteins, Golgi Bodies,
G-Proteins, Immunoglobins, and
- Chem3D Pro 11.0
This premier application for desktop molecular modeling and protein
visualization provides support for state-of-the-art open GL graphics
and stereo hardware. Build small molecules using the ChemDraw interface
and see the 3D structure appear simultaneously, perform basic Molecular
modeling computations such as Dihedral driver MM2 experiments, Molecular
Mechanics and Dynamics. Perform ab initio calculations with an interface
to GAMESS.
- ChemFinder Std 11.0
ChemFinder Std is a database management system appropriate for anyone
who works with chemical information and chemical structure databases.
Browse, create, search, and update databases with structural, numeric,
and text data via user-customizable forms, including structural and
sub-structural queries, as well as linking to related data in sub-forms.
View and edit structures in a variety of modes, automatically create
databases and forms for imported data, export and print.
- Struct=Name Pro 11.0
Struct⇔Name contains the leading comprehensive methods for converting
chemical structures into chemical names and names to structures. It
can be used for many types of compounds, including charged compounds
and salts, highly symmetric structures and many other types of inorganic
and organometallics.
- ChemNMR Pro 11.0
ChemNMR can be used to accurately estimate 13C and 1H (proton) chemical
shifts. The molecule and the spectrum appear in a new window. The chemical
shifts are displayed on the molecule and the spectrum is linked to
the structure so that clicking on a peak in the spectrum highlights
the related fragment on the molecule.
- E-Notebook Pro 11.0
E-Notebook Pro allows users to maintain configurable lab journals with
pages from ChemDraw, Microsoft Word, Excel, PowerPoint and spectral
software. Search by structure and text, Draw reactions in ChemDraw.
E-Notebook performs stoichiometric calculations dependant upon the
reaction and other entered parameters. Retain a complete Audit trail
of experiments at each save, including username and timestamp, share
prewritten protocols that automatically add data from experiments using
AutoText.
- ChemDraw ActiveX/Plugin Pro 11.0
This premier ActiveX Control/Plugin allows you to query online databases
and view & publish online structures. This installer will automatically
install the necessary Plugin or ActiveX controls based on your web
browser(s). It adds save and print abilities to ChemDraw ActiveX/Plugin
Net.
- Chem3D ActiveX Pro 11.0
This premier ActiveX Control/Plugin allows you to view & publish
online structures in 3D. This installer will automatically install
the necessary Plugin or ActiveX controls based on your web browser(s).
It adds save and print abilities to Chem3D ActiveX/Plugin Net.
- MestReC Std
MestRe-C Std is a 1D only application for data processing,
visualization and analysis of NMR data. The program provides a variety
of conversion facilities for most NMR spectrometer formats and includes
all the conventional processing, displaying and plotting capabilities
of an NMR program, as well as more advanced processing techniques.
MestReC Std is a 1D only version of MestReC which offers the user
basic processing and analysis capabilities. The full version of MestReC
is available through either the CambridgeSoft online store or directly
through MESTRELAB RESEARCH.
Databases Included
- ChemINDEX Ultra 10.0 DVD Edition
This premier collection of databases is an extensive chemical reference
library for Windows. It includes ChemINDEX 8.0, ChemRXN 8.0, and NCI & AIDS
data on a DVD, with ChemOffice Net software.
Applications Features
(W) - Feature available on Win only
BioDraw
- Annotations
Store annotations for each element in your drawing. Annotation data ranges
from manually entered text to attached documents, literature references
or links.
- BioArt
A ChemDraw palette of customizable common biochemistry symbols including
membranes, cellular structures and more.
- Drawing Elements
Draw with common pathway elements such as membranes, DNA, enzymes, receptors,
and reaction arrows. tRNA, Ribosomes, Helix Proteins, Golgi Bodies, G-Proteins,
Immunoglobins, Mitochondrion and more!
- Integration
BioDraw works seamlessly with your other desktop programs so you can
use your pathways in presentations and publications.
- Pathway Diagrams
BioDraw includes drawing tools specifically designed for pathway diagrams;
you can create beautiful pathway diagrams in a matter of minutes.
- Plasmid
Map Tool
Create a plasmid map entering the number of base pairs in the plasmid
map and specifying ranges for regions and locations and labels for markers.
- Rotation & Integration
Rotate BioDraw objects and combine them with chemical structures.
Chem3D
- ChemProp
(W) Advanced property parameter including BP, MP and more.
- Dihedral Driver
(W) New conformational analysis tool allows the generation of MM2 energy
plots.
- Enhanced Graphics
(W) Chem3D uses openGL to provide high quality graphics display.
- Group
Labels
(W) Display group labels in the Chem3D model view.
- Hydrogen Bonds
(W) Automatically display hydrogen bonds in the 3D view!
- Kekule / Delocalized
Display Mode
(W) Toggle between dashed line and alternating single-double bond representation
of delocalized and aromatic bonds.
- MM2
(W) Built in support for MM2 to generate realistic 3D structures.
- Model
Explorer
(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.
- Molecular Modeling & Dynamics
(W) Workstation quality molecular modeling.
- PowerPoint
(W) Embed Chem3D models in PowerPoint files. Rotate and zoom Chem3D models
while giving a presentation.
- Spectrum Viewer
(W) Display spectral calculation results from Jaguar, Gaussian, and GAMESS
as a graphical display in a separate window.
- Stereo Hardware Support
(W) 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.
- BioDraw
Draw biological pathways.
- Chem3D LiveLink
(W) See what structures look like in 3D in a floating window and open
Chem3D with a single click from within ChemDraw.
- ChemDraw/Excel
(W) 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
(W) 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
(W) 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
(W) 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
(W) Include third party ActiveX controls on your ChemFinder form.
- Automatic
Form Generation
(W) Automatically build or extend databases by importing structures from
collections of structure files, databases, SDFiles, or other sources.
- CAL
Programming
(W) CAL is a simple programming language, accessible to non-programmers
allows automation, self-running demos, custom operations; includes debugging
features.
- 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.
- Chemical Searching
(W) 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
(W) 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
(W) Merge hitlists with any logic: intersect, union, subtract,
reverse subtract.
- Multiple Data Views
(W) View records one at a time, in a table view or a multiform view.
- Subforms
(W) Link relational data to your main table via subforms.
- Tabbed Forms
(W) Partition a form into sections using tabbed form pages.
E-Notebook
- Audit Trails
(W) Retain a complete copy of the experiment for each save, including
username and timestamp.
- AutoText
(W) Share prewritten protocols that dynamically add data from the experiment.
- ChemDraw & Stoichiometry
Calculations
(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.
- Configurability
(W) Design forms and add buttons that are tailored to your needs. (multiple-user
configuration only)
- Document Pages
Pages contain Excel spreadsheets, Word documents, ChemDraw drawings,
spectral data, images and PowerPoint slides.
- Extensive Data Types
(W) Notebook pages include ChemDraw reaction schemes, Microsoft Word
and Excel documents, and spectral data using the Galactic Spectral Control.
- Microsoft
Office & Galactic Spectra
(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 noteboo
- Multiple Projects
E-Notebook combines all your notebooks into one. Organize project notebooks
the way you work.
- Retrieval
Search by structure, keyword, dates and other types of data.
System Requirements
- Windows 2000, XP, Vista (32-bit only); Excel add-ins require
MS Excel 2000, 2003, or XP
- Mac OS X 10.3.x PowerPC, 10.4.x PowerPC, 10.4.x
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