Parmbsc1: a refined force field for DNA simulations von Ivani, Ivan, Dans, Pablo D, Noy, Agnes, Pérez, Alberto, Faustino, Ignacio, Hospital, Adam, Walther, Jürgen, Andrio, Pau, Goñi, Ramon, Balaceanu, Alexandra, Portella, Guillem, Battistini, Federica, Gelpí, Josep Lluis, González, Carlos, Vendruscolo, Michele, Laughton, Charles A, Harris, Sarah A, Case, David A, Orozco, Modesto

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MDWeb and MDMoby: an integrated web-based platform for molecular dynamics simulations von HOSPITAL, Adam, ANDRIO, Pau, FENOLLOSA, Carles, CICIN-SAIN, Damjan, OROZCO, Modesto, LLUIS GELPI, Josep

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Using interactive Jupyter Notebooks and BioConda for FAIR and reproducible biomolecular simulation workflows von Bayarri, Genís, Andrio, Pau, Gelpí, Josep Lluís, Hospital, Adam, Orozco, Modesto

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BIGNASim: a NoSQL database structure and analysis portal for nucleic acids simulation data von Hospital, Adam, Andrio, Pau, Cugnasco, Cesare, Codo, Laia, Becerra, Yolanda, Dans, Pablo D, Battistini, Federica, Torres, Jordi, Goñi, Ramón, Orozco, Modesto, Gelpí, Josep Ll

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pyPcazip: A PCA-based toolkit for compression and analysis of molecular simulation data von Shkurti, Ardita, Goni, Ramon, Andrio, Pau, Breitmoser, Elena, Bethune, Iain, Orozco, Modesto, Laughton, Charles A.

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BioExcel Building Blocks Workflows (BioBB-Wfs), an integrated web-based platform for biomolecular simulations von Bayarri, Genís, Andrio, Pau, Hospital, Adam, Orozco, Modesto, Gelpí, Josep Lluís

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BioExcel Building Blocks REST API (BioBB REST API), programmatic access to interoperable biomolecular simulation tools von Bayarri, Genís, Andrio, Pau, Hospital, Adam, Orozco, Modesto, Gelpí, Josep Lluís

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BioExcel Building Blocks Workflows (BioBB-Wfs), an integrated web-based plartform for biomolecular simulations von Bayarri, Genís, Andrio, Pau, Hospital Gasch, Adam, Orozco López, Modesto, Gelpi Buchaca, Josep Lluís

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High-Throughput Prediction of the Impact of Genetic Variability on Drug Sensitivity and Resistance Patterns for Clinically Relevant Epidermal Growth Factor Receptor Mutations from... von Suriñach, Aristarc, Hospital Gasch, Adam, Westermaier, Yvonne, Jordà Bordoy, Luis, Orozco Ruiz, Sergi, Beltrán, Daniel, Colizzi, Francesco, Andrio, Pau, Soliva, Robert, Municoy, Martí, Gelpi Buchaca, Josep Lluís, Orozco López, Modesto

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High-Throughput Prediction of the Impact of Genetic Variability on Drug Sensitivity and Resistance Patterns for Clinically Relevant Epidermal Growth Factor Receptor Mutations from... von Suriñach, Aristarc, Hospital, Adam, Westermaier, Yvonne, Jordà, Luis, Orozco-Ruiz, Sergi, Beltrán, Daniel, Colizzi, Francesco, Andrio, Pau, Soliva, Robert, Municoy, Martí, Gelpí, Josep Lluís, Orozco, Modesto

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BioExcel Building Blocks, a software library for interoperable biomolecular simulation workflows von Andrio, Pau, Hospital, Adam, Conejero, Javier, Jordá, Luis, Del Pino, Marc, Codo, Laia, Soiland-Reyes, Stian, Goble, Carole, Lezzi, Daniele, Badia, Rosa M., Orozco, Modesto, Gelpi, Josep Ll

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Making Canonical Workflow Building Blocks Interoperable across Workflow Languages von Soiland-Reyes, Stian, Bayarri, Genís, Andrio, Pau, Long, Robin, Lowe, Douglas, Niewielska, Ania, Hospital, Adam, Groth, Paul

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SEABED: Small molEcule activity scanner weB servicE baseD von Fenollosa, Carlos, Otón, Marcel, Andrio, Pau, Cortés, Jorge, Orozco, Modesto, Goñi, J Ramon

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BIGNASim: A NoSQL database structure and analysis portal for nucleic acids simulation data von Hospital Gasch, Adam, Andrio, Pau, Cugnasco, Cesare, Codo, Laia, Becerra, Yolanda, Dans, Pablo D, Battistini, Federica, Torres, Jordi, Goñi Macià, Josep Ramon, Orozco López, Modesto, Gelpí Buchaca, Josep Lluís

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BIGNASim: A NoSQL database structure and analysis portal for nucleic acids simulation data von Hospital Gasch, Adam, Andrio, Pau, Cugnasco, Cesare, Codo, Laia, Becerra, Yolanda, Dans, Pablo D, Battistini, Federica, Torres, Jordi, Goñi Macià, Josep Ramon, Orozco López, Modesto, Gelpí Buchaca, Josep Lluís

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BIGNASim: A NoSQL database structure and analysis portal for nucleic acids simulation data von Hospital Gasch, Adam, Andrio, Pau, Cugnasco, Cesare, Codo, Laia, Becerra, Yolanda, Dans, Pablo D, Battistini, Federica, Torres, Jordi, Goñi Macià, Josep Ramon, Orozco López, Modesto, Gelpí Buchaca, Josep Lluís

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BioExcel Building Blocks, a software library for interoperable biomolecular simulation workflows von Andrio, Pau, Hospital Gasch, Adam, Conejero, Javier, Jordá, Luis, Del Pino, Marc, Codo, Laia, Soiland-Reyes, Stian, Goble, Carole, Lezzi, Daniele, Badia, Rosa M, Orozco López, Modesto, Gelpí Buchaca, Josep Lluís

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Parmbsc1: A refined force-field for DNA simulations von Ivani, Ivan, Dans, Pablo D, Noy, Agnes, Pérez, Alberto, Faustino Pló, Ignacio, Hospital Gasch, Adam, Walther, Jürgen, Andrio, Pau, Goñi Macià, Josep Ramon, Balaceanu, Alexandra, Portella, Guillem, Battistini, Federica, Gelpí Buchaca, Josep Lluís, González, Carlos, Vendruscolo, Michele, Laughton, Charles A, Harris, Sarah A, Case, David A, Orozco López, Modesto

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Parmbsc1: A refined force-field for DNA simulations von Ivani, Ivan, Dans, Pablo D, Noy, Agnes, Pérez, Alberto, Faustino Pló, Ignacio, Hospital Gasch, Adam, Walther, Jürgen, Andrio, Pau, Goñi Macià, Josep Ramon, Balaceanu, Alexandra, Portella, Guillem, Battistini, Federica, Gelpí Buchaca, Josep Lluís, González, Carlos, Vendruscolo, Michele, Laughton, Charles A, Harris, Sarah A, Case, David A, Orozco López, Modesto

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Parmbsc1: A refined force-field for DNA simulations von Ivani, Ivan, Dans, Pablo D, Noy Freixa, Agnès, Pérez, Alberto, Faustino Pló, Ignacio, Hospital Gasch, Adam, Walther, Jürgen, Andrio, Pau, Goñi Macià, Josep Ramon, Balaceanu, Alexandra, Portella, Guillem, Battistini, Federica, Gelpí Buchaca, Josep Lluís, González, Carlos, Vendruscolo, Michele, Laughton, Charles A, Harris, Sarah A, Case, David A, Orozco López, Modesto

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