Computational Chemistry / Cheminformatics services
Informatics Outsourcing offers best solutions for organizations in computational chemistry. We can draw up catalogs that are mineable with your chemical structures and all data can easily be stored into one or several databanks.
Features of our Computational Chemistry Services
The chemical structures can be drawn manually or can be imported from SDF files that can be created using different software tools.
Informatics Outsourcing may be utilized as an extended arm of Customer's Research and Development activities for identifying the New Chemical Entities (NCEs).
Informatics Outsourcing and the customer will be using their respective strengths and technologies in drug discovery to jointly carry out target and compound screening toward identification of NCEs.
Data Mining and Molecular Modeling :
Informatics Outsourcing is well equipped to carry out the following Data Mining and Molecular Modeling activities as part of full drug discovery cycle.
Target identification from Public Domain Sources
Selecting the target lists for screening.
Identification of Hits through virtual screening.
Virtual Lead Optimization through QSAR and other modeling methods.
Informatics Outsourcing's internal development tools such as Text Mining and Compound Library Maker will be completely utilized for the project as and when they are required along with the other industry standard molecular modeling and cheminformatics products.
Other Services in Computational Chemistry
Customizable software tools development for computational chemistry / cheminformatics.
Customization of existing tools available in the market to suit the scientists' requirements.
Outsource Computational Chemistry Services :
We have well trained software professionals and statisticians to carry out complicated tasks in the field of Computational Chemistry. Feel free to CONTACT US for more information.