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TITLE: MD Simulations Reveal an Alternative Pathway for Dioxygen Diffusion in Aa3 Cytochrome C Oxidases
AUTHORS: Ana Sofia F Oliveira; Joao M Damas; Antonio M Baptista; Claudio M Soares;
PUBLISHED: 2014, SOURCE: 58th Annual Meeting of the Biophysical-Society in BIOPHYSICAL JOURNAL, VOLUME: 106, ISSUE: 2
INDEXED IN: WOS
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TITLE: The Pathway for O-2 Diffusion inside CotA Laccase and Possible Implications on the Multicopper Oxidases Family  Full Text
AUTHORS: Joao M Damas; Antonio M Baptista; Claudio M Soares;
PUBLISHED: 2014, SOURCE: JOURNAL OF CHEMICAL THEORY AND COMPUTATION, VOLUME: 10, ISSUE: 8
INDEXED IN: Scopus WOS CrossRef
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TITLE: Putative dioxygen-binding sites and recognition of tigecycline and minocycline in the tetracycline-degrading monooxygenase TetX  Full Text
AUTHORS: Gesa Volkers; Joao M Damas; Gottfried J Palm; Santosh Panjikar; Claudio M Soares ; Winfried Hinrichs;
PUBLISHED: 2013, SOURCE: ACTA CRYSTALLOGRAPHICA SECTION D-BIOLOGICAL CRYSTALLOGRAPHY, VOLUME: 69, ISSUE: 9
INDEXED IN: Scopus WOS CrossRef
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TITLE: Predicting the Thermodynamics and Kinetics of Helix Formation in a Cyclic Peptide Model  Full Text
AUTHORS: Joao M Damas; Luis C S Filipe; Sara R R Campos; Diana Lousa ; Bruno L Victor; Antonio M Baptista; Claudio M Soares ;
PUBLISHED: 2013, SOURCE: JOURNAL OF CHEMICAL THEORY AND COMPUTATION, VOLUME: 9, ISSUE: 11
INDEXED IN: Scopus WOS CrossRef
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TITLE: Accurate Prediction of Kinetics and Thermodynamics of a Peptide Model using mu s-long MD Simulations  Full Text
AUTHORS: Damas, JM; Filipe, LCS; Campos, SRR; Lousa, D; Victor, BL; Baptista, AM; Soares, CM;
PUBLISHED: 2013, SOURCE: 9th European-Biophysical-Societies-Association Congress in EUROPEAN BIOPHYSICS JOURNAL WITH BIOPHYSICS LETTERS, VOLUME: 42
INDEXED IN: WOS
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TITLE: Exploring the dioxygen diffusion pathways in aa3 Cytochrome c oxidases: Insights from MD simulations  Full Text
AUTHORS: Oliveira, ASF; Damas, JM; Baptista, AM; Soares, CM;
PUBLISHED: 2013, SOURCE: 9th European-Biophysical-Societies-Association Congress in EUROPEAN BIOPHYSICS JOURNAL WITH BIOPHYSICS LETTERS, VOLUME: 42
INDEXED IN: WOS