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This premier chemistry suite includes ChemBioDraw Ultra 12.0, MNova Std/Lite, ChemScript, ChemBio3D Ultra 12.0, ChemBioFinder Pro 12.0, ChemDraw/Excel, and E-Notebook Ultra 12.0, the ChemDraw and Chem3D ActiveX Pro Plugins & Controls, as well as the ChemINDEX (Index, RXN, NCI & AIDS) databases.
ChemOffice Pro 2010 features now available:
- E-Notebook
- Offline mode -- work offline and sync later
- Full text search -- search contents of collections, documents, and styled text fields
- ChemBioDraw
- Sequence Tool with disulphide bonds, sequence wrapping and shaping
- Struct=Name enhanced support for fused and bridged ring systems
- Name=Struct ambiguous name recognition
- Documents can contain over 16 million colors
- ChemBio3D
- Stochastic conformational sampling
ChemOffice Pro 2010 adds ChemBioDraw Ultra, ChemBio3D Ultra, ChemBioFinder Pro, ChemNMR, Name=Struct, ClogP, and the ChemINDEX (Index, RXN, NCI & AIDS) database, to ChemOffice Std 2010.
(W = Windows Only)
Applications
Applications Included
ChemBioDraw
Ultra 12.0
ChemBio3D
Ultra 12.0
ChemBioFinder
Pro 12.0
E-Notebook
Pro 12.0
ChemDraw
ActiveX/Plugin Pro 12.0
Chem3D
ActiveX Pro 12.0
ChemDraw/Excel
Pro 12.0
ChemNMR
Pro 12.0
Struct=Name
Pro 12.0
ChemScript
Pro 12.0
MNova
Std/Lite
Features
Applications Features
(W) - Feature available on Win only
ChemBioDraw Ultra 12.0
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.
Annotations
Store
annotations for each element 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.
BioArt
A
ChemDraw palette of customizable common biochemistry
symbols including membranes, cellular structures
and more.
BioDraw
Draw
biological pathways.
Chem3D
HotLink
(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.
ChemNMR
Predict
Proton NMR spectra with splitting patterns.
Also predict Carbon-13 NMR spectra. Spectra
and peaks are linked to the structure for
clear interpretation.
ChemNMR
User Proton Shift Database
Users
can add their own shift correction data for
proton prediction which can supplement the
existing data used by the ChemNMR algorithm.
CLogP
CLogP/CMR
provides the latest methodology for calculationg
n-octanol/water partition coefficients and
molar refractivity.
CLogP
(W)
CLogP property server provides the latest
methodology for calculationg n-octanol/water
partition coefficients.
Color
Faded Shapes
Shapes
can now be filled with a faded color.
Custom
Templates & Nicknames
Ability
to create & edit templates & nicknames.
Database
HotLink
Search
CambridgeSoft databases for chemical structures
in real time as you draw.
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!
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.
High
Color Templates
A
set of high color pathway and element templates.
High-color
Documents
Documents
can contain over 16 million colors.
I/Draw
Mode
New
compatibility mode allows ChemDraw to look
and feel like your legacy drawing package.
Integration
BioDraw
works seamlessly with your other desktop programs
so you can use your pathways in presentations
and publications.
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.
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.
Polymer
Draw
Represent
and manipulate polymers in ChemDraw.
Properties
HotLink
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.
Rotation
& Integration
Rotate
BioDraw objects and combine them with chemical
structures.
Rotation
about Arbitrary Centers
Change
the center of rotation using adjustment handle
on the Lasso and Marquee tools. Rotation will
now be centered on the selected origin.
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.
ChemBio3D Ultra 12.0
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.
ChemDraw
HotLink
(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.
ChemProp
(W)
Advanced property parameter including BP,
MP and more.
CLogP
(W)
CLogP property server provides the latest
methodology for calculationg n-octanol/water
partition coefficients.
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.
Formal
Charges
(W)
Assign Formal Charges to Atoms and Chem3D
will generate delocalized charges automatically.
GAMESS
Interface
(W)
Chem3D interface to GAMESS.
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.
MMFF94
(W)
MMFF94 is a molecular mechanics force-field
that supports both organic molecules and biopolymers.
MMFF94 force field provides a richer set of
atom types than MM2.
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.
MOPAC
Interface
(W)
Chem3D interface to MOPAC. (Note: MOPAC application
is required. See applications included section
to clarify.)
Multiprocessor
Support
Enable
multiprocessor support in MMFF94 calculations.
Partial
Surfaces
(W)
Generate and display partial surfaces for
protein active sites.
PowerPoint
(W)
Embed Chem3D models in PowerPoint files. Rotate
and zoom Chem3D models while giving a presentation.
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.)
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.
Stochastic
Conformational Analysis
Determination
of low-energy minima of a molecule using a
stochastic conformational jump procedure.
Structure
Browser
(W)
Allows users to easily scroll through a collection
of small molecules and compare their structures
and properties.
ChemBioFinder Pro 12.0
ActiveX
Control Boxes
(W)
Include third party ActiveX controls on your
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 ChemBioViz 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.
Python
Scripting
Python
scripts can be written to automate the application
and can be attached to buttons on the form
or to database trigger events. User the enhanced
Script Editor to develop and debug -- now
featuring interactive line-by-line execution
-- and display output in a new dockable text
window.
Standardized
Handling of Implict Hydrogens
Conforms
to industry standards.
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 Pro 12.0
Audit
Trails
(W)
Retain a complete copy of the experiment for
each save, including username and timestamp.
Audit
Trails
Changes
to locations, containers and compounds are
logged to the database.
AutoText
(W)
Share prewritten protocols that dynamically
add data from the experiment.
Batch
Explorer
View
a reaction tree showing successors and predecessors
of a selected batch or compound.
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.
Full
Text Search
Search
contents of collections, documents, and styled
text fields.
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.
Offline
Mode
Work
offline and synchronize later.
Retrieval
Search
by structure, keyword, dates and other types
of data.
SQL
Server Express 2005
(W)
E-Notebook works with SQL Server Express 2005,
which has self-tuning capabilities that respond
to changing usage characteristics. The allowed
database size limit is twice the previous
limit for MSDE (SQL Server 2000).
ChemDraw ActiveX/Plugin Pro 12.0
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.
Annotations
Store
annotations for each element 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.
Chemical
File Format
Reading
& writing of chemical file formats including
spectra & reactions.
Chemical
Warnings
Mouse-over
red box to read error description.
Color
Faded Shapes
Shapes
can now be filled with a faded color.
Custom
Templates & Nicknames
Ability
to create & edit templates & nicknames.
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.
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.
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
HotLink
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.
Stereochemistry
Identifies
stereocenters using Cahn-Ingold Prelog rules.
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.
Chem3D ActiveX Pro 12.0
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.
PowerPoint
(W)
Embed Chem3D models in PowerPoint files. Rotate
and zoom Chem3D models while giving a presentation.
ChemDraw/Excel Pro 12.0
ChemDraw/Excel
(W)
Use Excel to organize and analyze your chemical
data.
Name=Struct/Excel
(W)
Generate a ChemDraw structure in MS Excel
by typing in systematic chemical names for
most substances.
ChemNMR Pro 12.0
ChemNMR
Predict
Proton NMR spectra with splitting patterns.
Also predict Carbon-13 NMR spectra. Spectra
and peaks are linked to the structure for
clear interpretation.
ChemNMR
User Proton Shift Database
Users
can add their own shift correction data for
proton prediction which can supplement the
existing data used by the ChemNMR algorithm.
Struct=Name Pro 12.0
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.
ChemScript Pro 12.0
ChemScript
Pro
Apply
chemical business rules to chemical objects
by using customizable scripts
System Requirements
- Windows 2000 SP4 (NOT supported for E-Notebook in ChemBioOffice 2010), XP Pro SP2 (32 bit only), Vista Business and Ultimate (32 bit only); MS Office 2000 (NOT supported by ChemDraw for Excel and Combi for Excel add-ins or E-Notebook in ChemOffice 2010), MS Office XP, MS Office 2003, MS Office 2007
For complete in-depth System Requirements, please visit the System Requirements page on the Support site.