The Ewald method has been the cornerstone in molecular simulations for modeling
electrostatic interactions of charge-stabilized many-body systems. In the late 1990s, Wolf and …

Amphotericin B is the most potent antimycotic known to date. However due to its large
collateral toxicity, its use, although long standing, had been limited. Many attempts have been …

Amphotericin B (AmB) is still the most effective drug for the treatment of systemic fungal
infections in humans. Despite significant theoretical and experimental efforts trying to understand …

In this work the renormalized jellium model of colloidal suspensions, originally proposed by
Trizac and Levin [Phys. Rev. E 69, 031403 (2004)], is extended to study mechanisms of …

From a computational point of view, a promising description for charged-stabilized fluids is
the so-called Wolf method, which is faster than the standard Ewald summation technique. …

Petroleum-based plastics dominate everyday life, necessitating the exploration of natural
polymers as alternatives. Starch, abundant and biodegradable, is a promising raw material. …

Recently, it has been demonstrated that electrostatic interactions between charged colloids
in contact with a symmetric electrolyte can accurately be described by using the so-called …

Lidocaine and bupivacaine are local anaesthetics used clinically to numb tissue in a specific
area. The anaesthetic effect of lidocaine starts twice as fast as bupivacaine, although it lasts …

The viral capsid is a macromolecular complex formed by a defined number of self-assembled
proteins, which, in many cases, are biopolymers with an identical amino acid sequence. …

A finales del año 2019 la población mundial se vio afectada por el brote de un nuevo virus,
bautizado como SARS-CoV-2, el cual causó la enfermedad conocida como COVID-19, …