Capturing volatile organic compounds using Ag and Au nanoparticles: regium–π and C–H⋯Ag/Au interactions at work

MN. Piña, J. Morey, A. Frontera, A. Bauzá

Journal of Materials Chemistry A.

Spodium Bonds Involving Methylmercury and Ethylmercury in Proteins: Insights from X-ray Analysis and Computations

S. Burguera, A. Kumar, A. Frontera, HS. Biswal, A. Bauzá

Inorganic Chemistry.

Biological noncovalent N/O⋯V interactions: insights from theory and protein data bank analyses

S. Burguera, A. Frontera, A. Bauzá

Physical Chemistry Chemical Physics.

Enzymatic reversion of Pt(ii) nucleophilicity through charge dumping: the case of Pt(CN)₄²⁻

S. Burguera, A. Frontera, A. Bauzá

Chemical Comunications.

Regium−π Bonds Involving Nucleobases: Theoretical Study and Biological Implications.

S. Burguera, A. Frontera, A. Bauzá

Inorg. Chem.

Tetrel bonds involving a CF₃ group participate in protein–drug recognition: a combined crystallographic and computational study.

MN. Piña, AK. Sahu, A. Frontera, HS. Biswal, A. Bauza

Phys. Chem. Chem. Phys.

Computational Study of Driving Forces in ATSP, PDIQ, and P53 Peptide Binding: C═O···C═O Tetrel Bonding Interactions at Work.

L. Lang, A. Frontera, A. Pérez, A. Bauzá

J. Chem. Inf. Model.

A Comprehensive Ab Initio Study of Halogenated A··· U and G··· C Base Pair Geometries and Energies.

RM. Gomila, A. Frontera, A. Bauzá

Int. J. Mol. Sci.

Structural predictions of protein–DNA binding: MELD-DNA.

R. Esmaeeli, A. Bauzá, A. Pérez

Nucleic Acids Res.