AKos
Consulting & Solutions GmbH
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a chemoinformatics company
 

Accelrys Product List
links will lead to pages on AKos GmbH
Accelrys Product List
links will lead to the Accelrys homepage

Accelrys Software - from Research to Manufacturing

Reading Specific Literature - getting an idea All Accelrys databases are linked to online journals. You need to have your own subscription to online journals. 
 
DiscoveryGate

Is it new or claimed?

  DiscoveryGate
 
Specific databases

Is it useful?

Databases with sufficient facts allow you to choose the most appropriate literature reference. Instead of printing 50 and more papers that collect dust, these databases help you to select the one or two papers that are really relevant to your question. All the database have links to the online journals, and provided you have a license you can jump directly to the original paper. DiscoveryGate
Comprehensive Medicinal Chemistry
AIDS Database
Accelrys® Drug Data Report
National Cancer Institute Databases
Metabolite Database
RTECS®

 
Sourcing and inventory applications.

Get a compound

 

 

Once you have made the decision what to do you need a compound. The easiest would be, if you could grab it from your desk, or from your neighbors lab, or from somewhere in the house, or get it delivered from the stockroom! The MDL Sourcing application can help you to find compounds easily. Obviously, the need to registered easily into the system. On way is you swipe the bottle over a bar coded reader and the system knows the new location of the bottle. Your scale is also connected to a computer and the difference in weight will be recorded if you take a sample. Isentris


 

Accelrys® Logistics

Buy a compound

 

What you can't get, you have to buy. Available Chemicals Directory (ACD) is the choice for buying fine chemicals. ACD contains Aldrich, Fluka, and 700 more suppliers. You will also find the building blocks from AKos GmbH in ACD.

Samples for screening are in SCD (Screening Compounds Directory).

DiscoveryGate
Reagent Selector
Available Chemicals Directory (ACD)
Screening Compounds Directory

In-house ISIS DB
CPI File
AKos Screening Samples

Reaction Databases

Make a compound

What you can't buy you have to make. Accelrys (MDL) has a huge collection of reactions. However reaction databases can differ quite substantially if you start searching.

ChemInform is the best choice for searching for group transformations. The underlying technology allows you to make very sophisticated queries, for instance you can define an aromatic bond.

Accelrys® Reaction Browser
DiscoveryGate

ChemInform
SPRESI
OrgSyn
JSM
SPORE
Theilheimer

Isentris Personal Edition

Register All your work represents a lot of knowledge and money. Nobody wants to loose this knowledge any more. But, you don't have the time to carefully register all your work. We take care of it that everything what you write and draw can be automatically stored properly. There are several tools. One is the MDL Notebook. Accelrys® ChemBio AE
Accelrys® Elan
Accelrys
® Chemistry Rules Interface
SD/FX Loader

Isentris Personal Edition

Screen Assay Explorer is the choice for designing screens, testing the compounds, analyzing the results and storing the data. Assay Explorer

Isentris Personal Edition

Report I want to see all the desired results with the click of one button. No problem use Report Manager. Report Manager is part of Assay Explorer.
Electronic Lab Journal

Bench-to-enterprise data and document architecture

Application-specific interfaces that support a diversity of science

Support of regulated and non-regulated environments

 

Accelrys has a clear strategy combining all its electronic labnotebooks into one single product. Former MDL had two products and Accelrys had one product.

The ELN comes with different modules:

Notebook: Discovery
Quickly design and record new reactions, or begin with reactions found in the corporate ELN database
 

Notebook: Process
Plan and record synthetic campaigns, from lab to pilot plant

Notebook: Analytical
Save time by recording analytical data in custom templates that enforce business rules

Notebook: Formulations
Design formulations, create custom batch tickets, and record batch data and analytical results

Notebook: BioProcess
Record bioprocess and analytical data in a corporate repository

 

     
     
     

Up Isentris Personal Edition SN6 DiscoveryGate