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| Collect screening compounds | - email
us for a CD of our screening samples, and get MDL®
Screening Compounds Directory
(over 2'000'000 screening compounds)
We provide the actual screening samples via our cooperation with |
over 120'000 samples |
| Select compounds by chemical criteria | - use Reagent Selector, with Chime (MDL® Chemistry Rules Interface) scripts | |
| Select compounds by biological criteria | - use the new
biological descriptors from PASS
PASS (Prediction of Activity Spectra for Substances) helps you to screen only a fraction of the samples to find large number of hits. We have shown that with 1% of the amount of samples, you find already 20% of the hits. - What does this mean? Instead of screening 5000 compounds it is sufficient to screen only 50 compounds, and you can be assured to find a large number of hits in this enriched selection. |
in-silico screening |
| Buy the compounds | - use Symyx® Logistics to store the entries and to produce the order | |
| Do the experiment | -use Assay
Explorer to record standardized notebook entries. Assay Explorer handles all your information and data needs to do, manage and analyze your experiments. |
biologist's notebook |
| Produce reports of your data | - use the MDL®Report Manager to produce quickly publishable reports | |
| Share the knowledge with the project group or company | -use ChemBio
as a turn-key application to share information among chemists and
biologist. ChemBio, is a storage and retrieval system for chemical and summary biological data. |
affordable company-wide chemical and biological information system |
| Design your library | - MDL® Notebook supports the expanding role of parallel chemistry, offering tools for building (reaction paradigm), synthesizing, archiving, and analyzing combinatorial libraries. | Supports robots: Gilson 215, Bohdan RAM, TECAN Genesis |
| Design your synthetic methodology | -use robust methods to synthesize your compounds. SPORE (Solid Phase Organic REactions) supplements the other reaction databases with comprehensive information about reactions on solid support. | comprehensive database |
| Buy building blocks | - we offer building building blocks. Have a look at our Building Block database |
515 compounds |
| Select compounds by chemical criteria | - use Reagent Selector, with Chime (MDL® Chemistry Rules Interface) scripts | |
| Build your library in the computer | -use MDL®Central Library to process reagents into libraries | |
| Select compounds by biological criteria | - use the new
biological descriptors from PASS
PASS (Prediction of Activity Spectra for Substances) helps you to screen only a fraction of the samples to find large number of hits. We have shown that with 1% of the amount of samples, you find already 20% of the hits. - What does this mean? Instead of screening 5000 compounds it is sufficient to screen only 50 compounds, and you can be assured to find a large number of hits in this enriched selection. |
-silico screening |
| Buy the compounds | - use SMART to store the entries and to produce the order | |
| Do the experiment | -use Assay
Explorer to record standardized notebook entries. Assay Explorer handles all your information and data needs to do, manage and analyze your experiments. |
biologist's notebook |
| Produce reports of your data | - use the MDL®Report Manager to produce quickly publishable reports | |
| Share the knowledge with the project group or company | -use
ChemBio
as a turn-key application to share information among chemists and
biologist. ChemBio, is a storage and retrieval system for chemical and summary biological data. |
affordable company-wide chemical and biological information system |
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