User Tools

Site Tools


start

Differences

This shows you the differences between two versions of the page.

Link to this comparison view

Both sides previous revisionPrevious revision
Next revision
Previous revision
Next revisionBoth sides next revision
start [2014/01/01 15:39] – [COMPOUND SOURCING] flackstart [2014/01/01 15:54] – [LEAD OPTIMIZATION] flack
Line 26: Line 26:
 ====== LEAD OPTIMIZATION ====== ====== LEAD OPTIMIZATION ======
  
-{{ :icon_big.png?65}}+{{ :icon_big.png?75}}
  
 Mcule offers a continuously growing set of intuitive, easy-to-use modeling applications specifically designed to evaluate and generate ideas in the hit/lead optimization process. In the course of a drug discovery project, after identifying a hit or lead molecule, the next step is the optimization of multiple properties of the hit/lead. Some of the properties that typically need further optimization are binding affinity to the target, selectivity (affinity to off-targets) and [[http://en.wikipedia.org/wiki/ADME|ADMET]] properties. Mcule offers a continuously growing set of intuitive, easy-to-use modeling applications specifically designed to evaluate and generate ideas in the hit/lead optimization process. In the course of a drug discovery project, after identifying a hit or lead molecule, the next step is the optimization of multiple properties of the hit/lead. Some of the properties that typically need further optimization are binding affinity to the target, selectivity (affinity to off-targets) and [[http://en.wikipedia.org/wiki/ADME|ADMET]] properties.
Line 45: Line 45:
 ====== MCULE DATABASE ====== ====== MCULE DATABASE ======
  
-__**[[http://mcule.com/database|DOWNLOAD DATABASE]]**__: The Mcule database can be downloaded in SDF format including Mcule IDs and 2D structures from **[[http://mcule.com/database/|HERE]]**. It can be processed in-house and you can come back with the Mcule IDs of the best hits to place an order **[[http://mcule.com/collection/create/from-ids/|HERE]]**.+**[[http://mcule.com/database|DOWNLOAD DATABASE]]**: The Mcule database can be downloaded in SDF format including Mcule IDs and 2D structures from **[[http://mcule.com/database/|HERE]]**. It can be processed in-house and you can come back with the Mcule IDs of the best hits to place an order **[[http://mcule.com/collection/create/from-ids/|HERE]]**.
  
 The Mcule database contains high quality molecule collections. All of them passed our in-house developed registration system: **[[regsys|MAC (Mcule Advanced Curation)]]**. The Mcule database contains high quality molecule collections. All of them passed our in-house developed registration system: **[[regsys|MAC (Mcule Advanced Curation)]]**.
start.txt · Last modified: 2024/04/28 23:04 by flack