David Ferro-Costas

Publication Activity (10 Years)

Years Active: 2021-2024
Publications (10 Years): 7

Top Topics

Capillary Electrophoresis

Molecular Dynamics

Metal Organic Framework

Top Venues

The journal of physical chemistry. C, Nanomaterials and interfaces

Journal of cheminformatics

Journal of chemical information and modeling

Physical chemistry chemical physics : PCCP

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

Publications

Thanh-Hiep Thi Le, David Ferro-Costas, Antonio Fernandez-Ramos, Manuel A Ortuño
Combined DFT and Kinetic Monte Carlo Study of UiO-66 Catalysts for γ-Valerolactone Production. The journal of physical chemistry. C, Nanomaterials and interfaces 128 (3) (2024)
David Ferro-Costas, Pedro A Sánchez-Murcia, Antonio Fernandez-Ramos
Unraveling the Catalytic Mechanism of β-Cyclodextrin in the Vitamin D Formation. Journal of chemical information and modeling (2024)
Thanh-Hiep Thi Le, David Ferro-Costas, Antonio Fernandez-Ramos, Manuel A Ortuño
Combined DFT and Kinetic Monte Carlo Study of UiO-66 Catalysts for γ-Valerolactone Production. The journal of physical chemistry. C, Nanomaterials and interfaces 128 (3) (2024)
David Ferro-Costas, Pedro A Sánchez-Murcia, Antonio Fernandez-Ramos
Unraveling the Catalytic Mechanism of β-Cyclodextrin in the Vitamin D Formation. Journal of chemical information and modeling 64 (9) (2024)
David Ferro-Costas, Maria Natália Dias Soeiro Cordeiro, Antonio Fernandez-Ramos
An integrated protocol to study hydrogen abstraction reactions by atomic hydrogen in flexible molecules: application to butanol isomers. Physical chemistry chemical physics : PCCP 24 (5) (2022)
David Ferro-Costas, Irea Mosquera-Lois, Antonio Fernandez-Ramos
Correction to: TorsiFlex: an automatic generator of torsional conformers. Application to the twenty proteinogenic amino acids. Journal of cheminformatics 14 (1) (2022)
David Ferro-Costas, Irea Mosquera-Lois, Antonio Fernandez-Ramos
TorsiFlex: an automatic generator of torsional conformers. Application to the twenty proteinogenic amino acids. Journal of cheminformatics 13 (1) (2021)