João M. Damas
João M. Damas
Syngenta Crop Protection R&D
Verified email at syngenta.com
Title
Cited by
Cited by
Year
The multicopper oxidase from the archaeon Pyrobaculum aerophilum shows nitrous oxide reductase activity
AT Fernandes, JM Damas, S Todorovic, R Huber, MC Baratto, R Pogni, ...
The FEBS journal 277 (15), 3176-3189, 2010
522010
Structural consequences of ATP hydrolysis on the ABC transporter NBD dimer: molecular dynamics studies of HlyB
JM Damas, ASF Oliveira, AM Baptista, CM Soares
Protein Science 20 (7), 1220-1230, 2011
502011
The role of Asp116 in the reductive cleavage of dioxygen to water in CotA laccase: assistance during the proton-transfer mechanism
CS Silva, JM Damas, Z Chen, V Brissos, LO Martins, CM Soares, ...
Acta Crystallographica Section D: Biological Crystallography 68 (2), 186-193, 2012
322012
Putative dioxygen-binding sites and recognition of tigecycline and minocycline in the tetracycline-degrading monooxygenase TetX
G Volkers, JM Damas, GJ Palm, S Panjikar, CM Soares, W Hinrichs
Acta Crystallographica Section D: Biological Crystallography 69 (9), 1758-1767, 2013
242013
Exploring O 2 diffusion in A-type cytochrome c oxidases: molecular dynamics simulations uncover two alternative channels towards the binuclear site
ASF Oliveira, JM Damas, AM Baptista, CM Soares
PLoS Comput Biol 10 (12), e1004010, 2014
212014
Predicting the thermodynamics and kinetics of helix formation in a cyclic peptide model
JM Damas, LCS Filipe, SRR Campos, D Lousa, BL Victor, AM Baptista, ...
Journal of chemical theory and computation 9 (11), 5148-5157, 2013
212013
High-throughput automated preparation and simulation of membrane proteins with HTMD
S Doerr, T Giorgino, G Martínez-Rosell, JM Damas, G De Fabritiis
Journal of chemical theory and computation 13 (9), 4003-4011, 2017
182017
The Pathway for O2 Diffusion inside CotA Laccase and Possible Implications on the Multicopper Oxidases Family
JM Damas, AM Baptista, CM Soares
Journal of Chemical Theory and Computation 10 (8), 3525–3531, 2014
162014
A scalable molecular force field parameterization method based on density functional theory and quantum-level machine learning
R Galvelis, S Doerr, JM Damas, MJ Harvey, G De Fabritiis
Journal of chemical information and modeling 59 (8), 3485-3493, 2019
122019
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Articles 1–9