Monthly Archives: March 2017

COMPUTER SIMULATIONS STUDIES OF PEPTIDES IN ORGANIC SOLVENTS AND COSOLVENTS: A SIMPLE DATABASE

SIMPEOS is a simple hypertextual database that provides a list of peptides that have been studied using molecular dynamics simulations in non-aqueous solvents.

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The Molecular Dynamics Docking Method

Understanding the mechanisms of the molecular recognition has fundamental impacts in medicine and biotechnology. It plays an important role in discovering new drugs and in developing new biocatalyst. The theoretical study of these mechanisms has boosted the development of approximated … Continue reading

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