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Computer simulations of proteins and other biomolecules can provide insights into biomolecular function, which may be essential for a true understanding of molecular mechanisms.

Our research is based on the use and development of computational strategies to tackle structure-function relationships that are not evident from the analysis of structural data, generally derived from crystallographic or NMR models. We have tight interaction with experimental groups, and we hope to suggest from the computational models new hypothesis that should be testable by experiments.

The group is also experienced in the application of large-scale optimization techniques to problems arising in computational chemistry and biochemistry.

CV Lattes


We thank the financial support of

Grants: FAPESP 2010/16947-9, 2013/05475-7, 2013/08293-7 , CNPq 470374/2013-6