Bhattacharyya, Mousumi (Date of defense: 2012-05-21)
Formation of a protein-ligand complex is opposed by the loss of rotational, translational and conformational degrees of freedom, but if the ligand binds in a conformation that does not corresponds to ...
Schmidtke, Peter (Date of defense: 2011-10-14)
El trabajo presentado en esta tesis cubre varios campos de investigación relacionados con el desarrollo de moléculas bioactivas. Se compone de cinco partes distintas que se resumen aquí. Predicción ...
Álvarez García, Daniel (Date of defense: 2014-12-18)
Computer-aided drug design is a key player in current drug discovery projects. Structure-based computational approaches use the target structural information to suggest potentially active and safe drugs. ...