SIMPEOS is a simple hypertextual database that provides a list of peptides that have been studied using molecular dynamics simulations in non-aqueous solvents. Continue reading
Month: March 2017
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 but fast methods for screening large compound libraries and protein-protein complexes. Continue reading
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