Vı́ctor Guallar

Importance of accurate charges in molecular docking: Quantum mechanical/molecular mechanical (QM/MM) approach

Art E. Cho, Vı́ctor Guallar, B. J. Berne et al. · Journal of Computational Chemistry · 2005 · 405 citations · Full text

Automated Design of Efficient and Functionally Diverse Enzyme Repertoires

Olga Khersonsky, Rosalie Lipsh‐Sokolik, Ziv Avizemer et al. · Molecular Cell · 2018 · 281 citations · Full text

Engineering, Directed Evolution, Synthetic Biology +6

PELE:  Protein Energy Landscape Exploration. A Novel Monte Carlo Based Technique

Kenneth Borrelli, Andreas Vitalis, Raul Alcantara et al. · Journal of Chemical Theory and Computation · 2005 · 228 citations

Engineering, Biomolecular Structure Prediction, Molecular Biology +18

Detection of SARS-CoV-2 in a cat owned by a COVID-19−affected patient in Spain

Joaquím Segalés, Mariona Puig, Jordi Rodon et al. · Proceedings of the National Academy of Sciences · 2020 · 184 citations · Full text

Productive Infection, Virus Epidemiology, Viral Diagnostics +14

The unravelling of the complex pattern of tyrosinase inhibition

Batel Deri, M. Kanteev, Mor Goldfeder et al. · Scientific Reports · 2016 · 169 citations · Full text