List of works - Sara Fortuna

A consensus protocol for the in silico optimisation of antibody fragments

scientific article published on 01 November 2019

A structural investigation of the interaction of oxalic acid with Cu(110) ⬇️

AMPA receptor GluA2 subunit defects are a cause of neurodevelopmental disorders

scientific article published on 12 July 2019

Accurate Estimation of the Entropy of Rotation-Translation Probability Distributions

scientific article published on 24 November 2015

Agent-Based Modeling for the 2D Molecular Self-Organization of Realistic Molecules ⬇️

scientific article published on August 12, 2010

An artificial intelligence approach for modeling molecular self-assembly: agent-based simulations of rigid molecules

scientific article published in July 2009

Biallelic mutations in neurofascin cause neurodevelopmental impairment and peripheral demyelination

Binding affinity prediction of nanobody-protein complexes by scoring of molecular dynamics trajectories

scientific article published on 12 January 2018

Chelating effect in short polymers for the design of bidentate binders of increased affinity and selectivity

scientific article published on 26 October 2015

Computational design of cyclic peptides for the customized oriented immobilization of globular proteins

scientific article published on 6 January 2017

Correction: In Silico Generation of Peptides by Replica Exchange Monte Carlo: Docking-Based Optimization of Maltose-Binding-Protein Ligands

scientific article published on 18 October 2016

Design, synthesis and antimycobacterial activity of benzoxazinone derivatives and open-ring analogues: Preliminary data and computational analysis

scientific article published on 17 July 2019

Discovery of new potent dual sigma receptor/GluN2b ligands with antioxidant property as neuroprotective agents

scientific article published on 08 July 2019

Distance-Based Configurational Entropy of Proteins from Molecular Dynamics Simulations

scientific article

Formation of Hybrid Electronic States in FePc Chains Mediated by the Au(110) Surface

Hexagonal Lattice Model of the Patterns Formed by Hydrogen-Bonded Molecules on the Surface

scientific article published on 01 February 2010

In Silico Generation of Peptides by Replica Exchange Monte Carlo: Docking-Based Optimization of Maltose-Binding-Protein Ligands.

scientific article published on 7 August 2015

Influence of Linker Flexibility on the Binding Affinity of Bidentate Binders

scientific article published on 5 April 2017

Molecular dynamics simulations and docking enable to explore the biophysical factors controlling the yields of engineered nanobodies

scientific article published on 10 October 2016

Molecule-Driven Substrate Reconstruction in the Two-Dimensional Self-Organization of Fe-Phthalocyanines on Au(110)

Mutations in the Neuronal Vesicular SNARE VAMP2 Affect Synaptic Membrane Fusion and Impair Human Neurodevelopment

scientific article published on 28 March 2019

Packing patterns of silica nanoparticles on surfaces of armored polystyrene latex particles

scientific article published in November 2009

Phase behaviour of self-assembled monolayers controlled by tuning physisorbed and chemisorbed states: A lattice-model view

scientific article published in April 2016

Polymer Vesicles with a Colloidal Armor of Nanoparticles

scientific article published on 26 January 2011

Spin and orbital configuration of metal phthalocyanine chains assembled on the Au(110) surface

scholarly article in Physical Review B, vol. 87 no. 16, April 2013

Structural Phases of Ordered FePc-Nanochains Self-Assembled on Au(110)

scientific article published on 07 September 2012

Wet-dry-wet drug screen leads to the synthesis of TS1, a novel compound reversing lung fibrosis through inhibition of myofibroblast differentiation

scientific article published on 17 December 2021

List of works by Sara Fortuna