Umberto Raucci (U Raucci)

Scopus Author ID ORCID

Publication Activity (10 Years)

Years Active: 2020-2024
Publications (10 Years): 25

Top Venues

Journal of chemical theory and computation

The journal of physical chemistry letters

Journal of chemical information and modeling

Journal of the American Chemical Society

Stanford University

University of Naples Federico II (PHD)

This page only lists publications with an associated author ORCID identifier.

Affiliation History

Stanford University Jan 07 2019

United States

Postdoctoral Associate

École nationale supérieure de chimie de Paris Oct 01 2018 - Dec 31 2018

France

Postdoctoral Associate

University of Naples Federico II Aug 01 2016 - Jul 31 2018

Italy

Postdoctoral Associate

Education History

University of Naples Federico II

Italy

PHD

Publications

Michael Faran, Dhiman Ray, Shubhadeep Nag, Umberto Raucci, Michele Parrinello, Gili Bisker
A Stochastic Landscape Approach for Protein Folding State Classification. Journal of chemical theory and computation (2024)
Michael Faran, Dhiman Ray, Shubhadeep Nag, Umberto Raucci, Michele Parrinello, Gili Bisker
A Stochastic Landscape Approach for Protein Folding State Classification. Journal of chemical theory and computation 20 (13) (2024)
Michael Faran, Dhiman Ray, Shubhadeep Nag, Umberto Raucci, Michele Parrinello, Gili Bisker
A Stochastic Landscape Approach for Protein Folding State Classification. Journal of chemical theory and computation 20 (13) (2024)
Dhiman Ray, Sudip Das, Umberto Raucci
Kinetic View of Enzyme Catalysis from Enhanced Sampling QM/MM Simulations. Journal of chemical information and modeling 64 (9) (2024)
Michael Faran, Dhiman Ray, Shubhadeep Nag, Umberto Raucci, Michele Parrinello, Gili Bisker
Correction to A Stochastic Landscape Approach for Protein Folding State Classification. Journal of chemical theory and computation (2024)
Michael Faran, Dhiman Ray, Shubhadeep Nag, Umberto Raucci, Michele Parrinello, Gili Bisker
Correction to A Stochastic Landscape Approach for Protein Folding State Classification. Journal of chemical theory and computation (2024)
Michael Faran, Dhiman Ray, Shubhadeep Nag, Umberto Raucci, Michele Parrinello, Gili Bisker
A Stochastic Landscape Approach for Protein Folding State Classification. Journal of chemical theory and computation 20 (13) (2024)
Michael Faran, Dhiman Ray, Shubhadeep Nag, Umberto Raucci, Michele Parrinello, Gili Bisker
Correction to A Stochastic Landscape Approach for Protein Folding State Classification. Journal of chemical theory and computation (2024)
Dhiman Ray, Sudip Das, Umberto Raucci
Kinetic View of Enzyme Catalysis from Enhanced Sampling QM/MM Simulations. Journal of chemical information and modeling (2024)
Michael Faran, Dhiman Ray, Shubhadeep Nag, Umberto Raucci, Michele Parrinello, Gili Bisker
A Stochastic Landscape Approach for Protein Folding State Classification. Journal of chemical theory and computation 20 (13) (2024)
Wenwen Xu, David M Sanchez, Umberto Raucci, Hantao Zhou, Xinning Dong, Mingqiu Hu, Christopher J Bardeen, Todd J Martinez, Ryan C Hayward
Photo-actuators via epitaxial growth of microcrystal arrays in polymer membranes. Nature materials (2023)
Friedrich Stricker, David M Sanchez, Umberto Raucci, Neil D Dolinski, Manuel S Zayas, Jan Meisner, Craig J Hawker, Todd J Martinez, Javier Read de Alaniz
A multi-stage single photochrome system for controlled photoswitching responses. Nature chemistry 14 (8) (2022)
Umberto Raucci, Valerio Rizzi, Michele Parrinello
Discover, Sample, and Refine: Exploring Chemistry with Enhanced Sampling Techniques. The journal of physical chemistry letters 13 (6) (2022)
Sukolsak Sakshuwong, Hayley Weir, Umberto Raucci, Todd J Martinez
Bringing chemical structures to life with augmented reality, machine learning, and quantum chemistry. The Journal of chemical physics 156 (20) (2022)
Umberto Raucci, David M Sanchez, Todd J Martinez, Michele Parrinello
Enhanced Sampling Aided Design of Molecular Photoswitches. Journal of the American Chemical Society 144 (42) (2022)
Bernardino Tirri, Gloria Mazzone, Alistar Ottochian, Jerôme Gomar, Umberto Raucci, Carlo Adamo, Ilaria Ciofini
A combined Monte Carlo/DFT approach to simulate UV-vis spectra of molecules and aggregates: Merocyanine dyes as a case study. Journal of computational chemistry 42 (15) (2021)
Umberto Raucci, Alessio Valentini, Elisa Pieri, Hayley Weir, Stefan Seritan, Todd J Martinez
Voice-controlled quantum chemistry. Nature computational science 1 (1) (2021)
Federico Coppola, Paola Cimino, Umberto Raucci, Maria Gabriella Chiariello, Alessio Petrone, Nadia Rega
Exploring the Franck-Condon region of a photoexcited charge transfer complex in solution to interpret femtosecond stimulated Raman spectroscopy: excited state electronic structure methods to unveil non-radiative pathways. Chemical science 12 (23) (2021)
Maria Gabriella Chiariello, Umberto Raucci, Greta Donati, Nadia Rega
Water-Mediated Excited State Proton Transfer of Pyranine-Acetate in Aqueous Solution: Vibrational Fingerprints from Ab Initio Molecular Dynamics. The journal of physical chemistry. A 125 (17) (2021)
Maria Gabriella Chiariello, Greta Donati, Umberto Raucci, Fulvio Perrella, Nadia Rega
Structural Origin and Vibrational Fingerprints of the Ultrafast Excited State Proton Transfer of the Pyranine-Acetate Complex in Aqueous Solution. The journal of physical chemistry. B 125 (36) (2021)
David M Sanchez, Umberto Raucci, Todd J Martinez
In Silico Discovery of Multistep Chemistry Initiated by a Conical Intersection: The Challenging Case of Donor-Acceptor Stenhouse Adducts. Journal of the American Chemical Society 143 (48) (2021)
D M Sanchez, Umberto Raucci, K N Ferreras, Todd J Martinez
Putting Photomechanical Switches to Work: An Ab Initio Multiple Spawning Study of Donor-Acceptor Stenhouse Adducts. The journal of physical chemistry letters 11 (18) (2020)
Umberto Raucci, Marika Savarese, Carlo Adamo, Ilaria Ciofini, Nadia Rega
Modeling the Electron Transfer Chain in an Artificial Photosynthetic Machine. The journal of physical chemistry letters 11 (22) (2020)
Umberto Raucci, Maria Gabriella Chiariello, Nadia Rega
Modeling Excited-State Proton Transfer to Solvent: A Dynamics Study of a Super Photoacid with a Hybrid Implicit/Explicit Solvent Model. Journal of chemical theory and computation 16 (11) (2020)
Umberto Raucci, Fulvio Perrella, Greta Donati, Maria Zoppi, Alessio Petrone, Nadia Rega
Ab-initio molecular dynamics and hybrid explicit-implicit solvation model for aqueous and nonaqueous solvents: GFP chromophore in water and methanol solution as case study. Journal of computational chemistry 41 (26) (2020)

Umberto Raucci.css-eqlu8i{font-size:small;padding-left:4px;} (U Raucci)

Publication Activity (10 Years)

Top Topics

Top Venues

Umberto Raucci (U Raucci)