Structural Bioinformatics: exciting times in a rapidly evolving field by Cláudio M. Soares, Diana Lousa

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Inter-domain communication mechanisms in an ABC importer: a molecular dynamics study of the MalFGK2E complex. by A Sofia F Oliveira, António M Baptista, Cláudio M Soares

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ATP hydrolysis and nucleotide exit enhance maltose translocation in the MalFGK2E importer by Bárbara Abreu, Carlos Cruz, A. Sofia F. Oliveira, Cláudio M. Soares

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Exploring O2 diffusion in A-type cytochrome c oxidases: molecular dynamics simulations uncover two alternative channels towards the binuclear site. by A Sofia F Oliveira, João M Damas, António M Baptista, Cláudio M Soares

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Viral entry mechanisms: the role of molecular simulation in unlocking a key step in viral infections by Mariana Valério, Carolina C. Buga, Manuel N. Melo, Cláudio M. Soares, Diana Lousa

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SARS-CoV-2 variants impact RBD conformational dynamics and ACE2 accessibility by Mariana Valério, Mariana Valério, Luís Borges-Araújo, Luís Borges-Araújo, Luís Borges-Araújo, Luís Borges-Araújo, Manuel N. Melo, Manuel N. Melo, Diana Lousa, Diana Lousa, Cláudio M. Soares, Cláudio M. Soares

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The Importance of Lipid Conjugation on Anti-Fusion Peptides against Nipah Virus by Marta C. Marques, Diana Lousa, Patrícia M. Silva, André F. Faustino, Cláudio M. Soares, Nuno C. Santos

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Regulation of the mechanism of Type-II NADH: Quinone oxidoreductase from S. aureus by Filipa V. Sena, Filipe M. Sousa, A. Sofia F. Oliveira, Cláudio M. Soares, Teresa Catarino, Manuela M. Pereira

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Exploring the molecular mechanisms of electron shuttling across the microbe/metal space by Catarina M Paquete, Bruno M. Fonseca, Davide eCruz, Tiago ePereira, Isabel ePacheco, Cláudio M Soares, Ricardo O Louro

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Microbial production of the plant flavanone hesperetin from caffeic acid by Erik K. R. Hanko, João Correia, Caio S. Souza, Alison Green, Jakub Chromy, Ruth Stoney, Cunyu Yan, Eriko Takano, Diana Lousa, Cláudio M. Soares, Rainer Breitling

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The nsp15 Nuclease as a Good Target to Combat SARS-CoV-2: Mechanism of Action and Its Inactivation with FDA-Approved Drugs by Margarida Saramago, Vanessa G. Costa, Caio S. Souza, Cátia Bárria, Susana Domingues, Sandra C. Viegas, Diana Lousa, Cláudio M. Soares, Cecília M. Arraiano, Rute G. Matos

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An electrogenic redox loop in sulfate reduction reveals a likely widespread mechanism of energy conservation by Américo G. Duarte, Teresa Catarino, Gaye F. White, Diana Lousa, Sinje Neukirchen, Cláudio M. Soares, Filipa L. Sousa, Thomas A. Clarke, Inês A. C. Pereira

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Characterization of the periplasmic redox network that sustains the versatile anaerobic metabolism of Shewanella oneidensis MR-1 by Mónica N. Alves, Sónia E. Neto, Alexandra S. Alves, Afonso eCarrêlo, Isabel ePacheco, Bruno M. Fonseca, Catarina M. Paquete, Cláudio M. Soares, Ricardo O Louro

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Study of the interactions of bovine serum albumin with a molybdenum(II) carbonyl complex by spectroscopic and molecular simulation methods. by Hélia F Jeremias, Diana Lousa, Axel Hollmann, Ana C Coelho, Carla S Baltazar, João D Seixas, Ana R Marques, Nuno C Santos, Carlos C Romão, Cláudio M Soares

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Computer-aided design and implementation of efficient biosynthetic pathways to produce high added-value products derived from tyrosine in Escherichia coli by Sofia Ferreira, Alexandra Balola, Anastasia Sveshnikova, Vassily Hatzimanikatis, Paulo Vilaça, Paulo Maia, Rafael Carreira, Ruth Stoney, Pablo Carbonell, Pablo Carbonell, Caio Silva Souza, João Correia, Diana Lousa, Cláudio M. Soares, Isabel Rocha

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Genomic evolution towards azole resistance in Candida glabrata clinical isolates unveils the importance of CgHxt4/6/7 in azole accumulation by Mónica Galocha, Romeu Viana, Pedro Pais, Ana Silva-Dias, Mafalda Cavalheiro, Isabel M. Miranda, Mieke Van Ende, Caio S. Souza, Catarina Costa, Joana Branco, Cláudio M. Soares, Patrick Van Dijck, Acácio G. Rodrigues, Miguel C. Teixeira

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Signatures in SARS-CoV-2 spike protein conferring escape to neutralizing antibodies. by Marta Alenquer, Filipe Ferreira, Diana Lousa, Mariana Valério, Mónica Medina-Lopes, Marie-Louise Bergman, Juliana Gonçalves, Jocelyne Demengeot, Ricardo B Leite, Jingtao Lilue, Zemin Ning, Carlos Penha-Gonçalves, Helena Soares, Cláudio M Soares, Maria João Amorim

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Signatures in SARS-CoV-2 spike protein conferring escape to neutralizing antibodies by Marta Alenquer, Filipe Ferreira, Diana Lousa, Mariana Valério, Mónica Medina-Lopes, Marie-Louise Bergman, Juliana Gonçalves, Jocelyne Demengeot, Ricardo B. Leite, Jingtao Lilue, Zemin Ning, Carlos Penha-Gonçalves, Helena Soares, Cláudio M. Soares, Maria João Amorim

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