The increasing availability of data related to genes, proteins and their modulation by small molecules has provided a vast amount of biological information leading to the emergence of systems biology and the broad use of simulation tools for data analysis. However, there is a critical need to develop cheminformatics tools that can integrate chemical knowledge with these biological databases and simulation approaches, with the goal of creating systems chemical biology.
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| http://www.ncbi.nlm.nih.gov/pmc/articles/PMC2734506 | PMC |
| http://dx.doi.org/10.1038/nchembio0807-447 | DOI Listing |
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