The Extent of Human Apolipoprotein AI Lipidation Strongly Affects the β-Amyloid Efflux Across the Blood-Brain Barrier in vitro

R Dal Magro, S Simonelli, A Cox, B Formicola… - Frontiers in …, 2019 - frontiersin.org
Much evidence suggests a protective role of high-density lipoprotein (HDL) and its major
apolipoprotein apoA-I, in Alzheimer's disease (AD). The biogenesis of nascent HDL derived …

Cell penetrating peptide modulation of membrane biomechanics by Molecular dynamics

G Grasso, S Muscat, M Rebella, U Morbiducci… - Journal of …, 2018 - Elsevier
The efficacy of a pharmaceutical treatment is often countered by the inadequate membrane
permeability, that prevents drugs from reaching their specific intracellular targets. Cell …

Structure-based virtual screening, molecular docking, molecular dynamics simulation and pharmacokinetic modelling of cyclooxygenase-2 (COX-2) inhibitor for the …

M Yadav, M Abdalla, M Madhavi, I Chopra… - Molecular …, 2022 - Taylor & Francis
Colorectal cancer is the third most frequent cause of cancer worldwide and is more
prevalent in older individuals of all ages. The recent statistics from World Health …

Multivalent interacting glycodendrimer to prevent amyloid-peptide fibril formation induced by Cu (II): A multidisciplinary approach

A Janaszewska, B Klajnert-Maculewicz… - Nano Research, 2018 - Springer
Amyloid peptide fibrillogenesis induced by Cu (II) ions is a key event in the pathogenesis of
Alzheimer's disease. Dendrimers have been found to be active in preventing fibril formation …

Conformational dynamics and stability of U-shaped and S-shaped amyloid β assemblies

G Grasso, M Rebella, S Muscat, U Morbiducci… - International journal of …, 2018 - mdpi.com
Alzheimer's disease is the most fatal neurodegenerative disorder characterized by the
aggregation and deposition of Amyloid β (Aβ) oligomers in the brain of patients. Two …

Free energy landscape of siRNA-polycation complexation: Elucidating the effect of molecular geometry, polymer flexibility, and charge neutralization

G Grasso, MA Deriu, V Patrulea, G Borchard, M Möller… - PLoS …, 2017 - journals.plos.org
The success of medical threatments with DNA and silencing interference RNA is strongly
related to the design of efficient delivery technologies. Cationic polymers represent an …

The role of structural polymorphism in driving the mechanical performance of the alzheimer's beta amyloid fibrils

G Grasso, M Rebella, U Morbiducci… - … in bioengineering and …, 2019 - frontiersin.org
Alzheimer's Disease (AD) is related with the abnormal aggregation of amyloid β-peptides
Aβ1− 40 and Aβ1− 42, the latter having a polymorphic character which gives rise to U-or S …

Insights into the effect of the G245S single point mutation on the structure of p53 and the binding of the protein to DNA

MG Lepre, SI Omar, G Grasso, U Morbiducci, MA Deriu… - Molecules, 2017 - mdpi.com
The transcription factor p53 is a potent tumor suppressor dubbed as the “guardian of the
genome” because of its ability to orchestrate protective biological outputs in response to a …

Unveiling the ESR1 conformational stability and screening potent inhibitors for breast cancer treatment

K Sharma, U Panwar, M Madhavi, I Joshi… - Medicinal …, 2024 - ingentaconnect.com
Background: The current study recognizes the significance of estrogen receptor alpha (ERα)
as a member of the nuclear receptor protein family, which holds a central role in the …

Characterization of the AXH domain of Ataxin‐1 using enhanced sampling and functional mode analysis

MA Deriu, G Grasso, JA Tuszynski… - Proteins: Structure …, 2016 - Wiley Online Library
Ataxin‐1 is the protein responsible for the Spinocerebellar ataxia type 1, an incurable
neurodegenerative disease caused by polyglutamine expansion. The AXH domain plays a …