Search filters

List of works by Fabio Polticelli

All-trans-retinoic acid and retinol binding to the FA1 site of human serum albumin competitively inhibits heme-Fe(III) association

scientific article published on 27 October 2015

Binding of direct oral anticoagulants to the FA1 site of human serum albumin

scientific article published on 09 October 2020

Computational Biology, Protein Engineering, and Biosensor Technology: a Close Cooperation for Herbicides Monitoring

Computational Methods for the Identification of Molecular Targets of Toxic Food Additives. Butylated Hydroxytoluene as a Case Study

scientific article published on 09 May 2020

Computational methods and tools for binding site recognition between proteins and small molecules: from classical geometrical approaches to modern machine learning strategies

scientific article published on 18 October 2019

Cupricyclins, novel redox-active metallopeptides based on conotoxins scaffold

scientific article

Directed evolution and in silico analysis of reaction centre proteins reveal molecular signatures of photosynthesis adaptation to radiation pressure

scientific article

DockingApp RF: A State-of-the-Art Novel Scoring Function for Molecular Docking in a User-Friendly Interface to AutoDock Vina

scientific article published on 15 December 2020

DockingApp: a user friendly interface for facilitated docking simulations with AutoDock Vina

scientific article

Dynamical Behavior of the Human Ferroportin Homologue from Bdellovibrio bacteriovorus: Insight into the Ligand Recognition Mechanism

scientific article published on 16 September 2020

Enhanced heme accessibility in horse heart mini-myoglobin: Insights from molecular modelling and reactivity studies.

scientific article published on 9 September 2015

Exploring the activity of polyamine analogues on polyamine and spermine oxidase: methoctramine, a potent and selective inhibitor of polyamine oxidase

scientific article published on 01 December 2019

Fragment-Based Ligand-Protein Contact Statistics: Application to Docking Simulations.

scientific article published on 21 May 2019

Haptoglobin and the related haptoglobin protein: the N-terminus makes the difference

scientific article published on 24 October 2020

In Silico Analysis of the Structural Dynamics and Substrate Recognition Determinants of the Human Mitochondrial Carnitine/Acylcarnitine SLC25A20 Transporter

scientific article published in 2023

LIBRA-WA: a web application for ligand binding site detection and protein function recognition

scientific article published on 6 November 2017

Molecular Characterization of Kunitz-Type Protease Inhibitors from Blister Beetles (Coleoptera, Meloidae)

scientific article published in 2022

Nitrophorins and nitrobindins: structure and function.

scientific article

Oxygen dissociation from ferrous oxygenated human hemoglobin:haptoglobin complexes confirms that in the R-state α and β chains are functionally heterogeneous

scientific article published on 01 May 2019

Structure/function/dynamics of photosystem II plastoquinone binding sites

scientific article

The plastoquinol-plastoquinone exchange mechanism in photosystem II: insight from molecular dynamics simulations

scientific article

Uncovering the structure and function of Pseudomonas aeruginosa periplasmic proteins by an in silico approach

scientific article published on 30 October 2019

Paulina is supported by:

About Paulina

Help