artículo académico

• ENE-ADDUCTS FROM 1,4-DIHYDROPYRIDINES AND ALPHA,BETA-UNSATURATED NITRILES: ASYNCHRONOUS TRANSITION STATES DISPLAYING AROMATIC FEATURES.  ORGANIC & BIOMOLECULAR CHEMISTRY.  20(44):8662-8671. 2022
• INTERSUBUNIT COUPLING ENABLES FAST CO2-FIXATION BY REDUCTIVE CARBOXYLASES.  ACS CENTRAL SCIENCE.  8(8):1091-1101. 2022
• ATOM-CONDENSED FUKUI FUNCTION IN CONDENSED PHASES AND BIOLOGICAL SYSTEMS AND ITS APPLICATION TO ENZYMATIC FIXATION OF CARBON DIOXIDE.  JOURNAL OF PHYSICAL CHEMISTRY A.  124(5):849-857. 2020
• HIGH LEVEL AB INITIO BINDING ENERGY DISTRIBUTION OF MOLECULES ON INTERSTELLAR ICES: HYDROGEN FLUORIDE.  MOLECULAR ASTROPHYSICS.  21. 2020
• AWAKENING THE SLEEPING CARBOXYLASE FUNCTION OF ENZYMES: ENGINEERING THE NATURAL CO2-BINDING POTENTIAL OF REDUCTASES.  JOURNAL OF THE AMERICAN CHEMICAL SOCIETY.  141(25):9778-9782. 2019
• ELECTRONIC STRUCTURE BENCHMARK CALCULATIONS OF INORGANIC AND BIOCHEMICAL CARBOXYLATION REACTIONS.  JOURNAL OF COMPUTATIONAL CHEMISTRY.  1-13. 2019
• FOUR AMINO ACIDS DEFINE THE CO2 BINDING POCKET OF ENOYL-COA CARBOXYLASES/REDUCTASES.  PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA.  116(28):13964-13969. 2019
• CATALYTIC REACTION MECHANISM IN NATIVE AND MUTANT CATECHOL-O-METHYLTRANSFERASE FROM THE ADAPTIVE STRING METHOD AND MEAN REACTION FORCE ANALYSIS.  JOURNAL OF PHYSICAL CHEMISTRY B.  122(38):8861-8871. 2018
• THE EFFECT OF THE ENVIRONMENT ON THE METHYL TRANSFER REACTION MECHANISM BETWEEN TRIMETHYLSULFONIUM AND PHENOLATE.  PHYSICAL CHEMISTRY CHEMICAL PHYSICS.  18:24033-24042. 2016