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Cecilia Coletti
ORCID
Publication Activity (10 Years)
Years Active: 2012-2023
Publications (10 Years): 8
Top Topics
High Prediction Accuracy
Continuous Domains
Binding Sites
Discrete Variables
Top Venues
J. Comput. Aided Mol. Des.
ICCSA (5)
ICCSA (2)
ICCSA (10)
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Publications
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Roberto Paciotti
,
Alessandro Marrone
,
Cecilia Coletti
,
Nazzareno Re
Improving the accuracy of the FMO binding affinity prediction of ligand-receptor complexes containing metals.
J. Comput. Aided Mol. Des.
37 (12) (2023)
Federico Palazzetti
,
Cecilia Coletti
,
Alessandro Marrone
,
Fernando Pirani
Potential Energy Surfaces for Noble Gas (Ar, Kr, Xe, Rn)-Propylene Oxide Systems: Analytical Formulation and Binding.
Symmetry
14 (2) (2022)
Roberto Paciotti
,
Cecilia Coletti
,
Alessandro Marrone
,
Nazzareno Re
The FMO2 analysis of the ligand-receptor binding energy: the Biscarbene-Gold(I)/DNA G-Quadruplex case study.
J. Comput. Aided Mol. Des.
36 (12) (2022)
Iogann Tolbatov
,
Alessandro Marrone
,
Roberto Paciotti
,
Nazzareno Re
,
Cecilia Coletti
Multilayered Modelling of the Metallation of Biological Targets.
ICCSA (10)
(2021)
Roberto Paciotti
,
Mariangela Agamennone
,
Cecilia Coletti
,
Loriano Storchi
Characterization of PD-L1 binding sites by a combined FMO/GRID-DRY approach.
J. Comput. Aided Mol. Des.
34 (8) (2020)
Cecilia Coletti
,
Federico Palazzetti
,
Roger W. Anderson
,
Vincenzo Aquilanti
Hypergeometric Polynomials, Hyperharmonic Discrete and Continuous Expansions: Evaluations, Interconnections, Extensions.
ICCSA (6)
(2019)
Vincenzo Aquilanti
,
Manuela S. Arruda
,
Cecilia Coletti
,
Robert G. Littlejohn
,
Robenilson F. Santos
Combinatorial and Geometrical Origins of Regge Symmetries: Their Manifestations from Spin-Networks to Classical Mechanisms, and Beyond.
ICCSA (5)
(2017)
Simone Fioccola
,
Fernando Pirani
,
Massimiliano Bartolomei
,
Cecilia Coletti
Influence of the Intermolecular Potential Energy on N _2 2 -N _2 2 Inelastic Collisions: A Quantum-Classical Study.
ICCSA (5)
(2017)
Danilo Calderini
,
Cecilia Coletti
,
Gaia Grossi
,
Vincenzo Aquilanti
Continuous and Discrete Algorithms in Quantum Chemistry: Polynomial Sets, Spin Networks and Sturmian Orbitals.
ICCSA (2)
(2013)
Cecilia Coletti
,
Nazzareno Re
Performance of DFT and MP2 Approaches for Geometry of Rhenium Allenylidenes Complexes and the Thermodynamics of Phosphines Addition.
ICCSA (1)
(2012)