Gabriel Aires Urquiza-Carvalho

According to our database, Gabriel Aires Urquiza-Carvalho authored at least 5 papers between 2016 and 2020.

Collaborative distances:

• Dijkstra number of six.
• Erdős number of five.

2020

PRIMoRDiA: A Software to Explore Reactivity and Electronic Structure in Large Biomolecules.

Igor Barden Grillo, Gabriel Aires Urquiza-Carvalho, Gerd Bruno Rocha

J. Chem. Inf. Model., 2020

Elucidating Enzymatic Catalysis Using Fast Quantum Chemical Descriptors.

Igor Barden Grillo, Gabriel Aires Urquiza-Carvalho, José Fernando Ruggiero Bachega, Gerd Bruno Rocha

J. Chem. Inf. Model., 2020

Semiempirical methods do Fukui functions: Unlocking a modeling framework for biosystems.

Igor Barden Grillo, Gabriel Aires Urquiza-Carvalho, Elton José Ferreira Chaves, Gerd Bruno Rocha

J. Comput. Chem., 2020

2018

Efficient algorithm for expanding theoretical electron densities in canterakis-zernike functions.

Gabriel Aires Urquiza-Carvalho, Gerd Bruno Rocha, Rafael López

J. Comput. Chem., 2018

2016

Assessment of semiempirical enthalpy of formation in solution as an effective energy function to discriminate native-like structures in protein decoy sets.

Gabriel Aires Urquiza-Carvalho, Wallace Duarte Fragoso, Gerd Bruno Rocha

J. Comput. Chem., 2016