Modelado molecular de análogos estructurales de las Acil homoserina lactonas en el sitio activo del receptor Lasr

TL;DR: “Essentials” covers force field and molecular orbital theory, Monte Carlo and Molecular Dynamics simulations, thermodynamic and electronic (spectroscopic) property calculation, condensed phase treatment and a few more topics, and is an alternative to Andrew R. Leach's well-established “Molecular Modeling” and Frank Jensen’s “Introduction to Computational Chemistry”.

TL;DR: Recent advances of protein flexibility, ligand sampling, and scoring functions—the three important aspects in protein-ligand docking are reviewed.

TL;DR: This study indicates that some strains of V. paradoxus degrade and grow on acyl-HSL signals as the sole energy and nitrogen sources.

TL;DR: The audience at the Baltimore lectures consisted mainly of American professors, and a few English men of science attended a larger or smaller number of the lectures as discussed by the authors, and they all dealt with the same matter, and show how much the author's attention was directed to the subject during his three months' sojourn in America.

TL;DR: A study on the reliability of the results obtained with the popular AutoDock program, which concludes that the Autodock program package is able to select the correct complexes based on the energy without prior knowledge of the binding site.