From 11th to 14th of September 2022, Antonio Viayna is participating in the “27th National Meeting on Medicinal Chemistry (NMMC27)”, organized by the Medicinal Chemistry Division of the Italian Chemical Society (DCF-SCI), at the city of Bari (Italy). Antonio, is presenting their work entitled “Combining Quantum Mechanics and Machine Learning in the search of the bioactive conformation…
Read MoreAfter some postponements and difficult years due to the COVID-19 Pandemics, the 21st edition of the O2BIP 2022 is finally here. It consist in a series of biannual meetings that are organized on the topic of oxygen-binding and sensing proteins. This year the congress will be held at Rome (Italy). From 6th to 9th of September 2022,…
Read MoreRecently, our group member Carol Estarellas has appeared in the 1st Ranking of Spanish and foreign female researchers working in Spain. This initiative is part of the commitment to gender equality policies of CSIC institution, with the aim to increase the visibility of female researchers and their work. This edition consists of a list of…
Read MoreLast 19th and 20th of July of 2022, our group took part in the traditional IQTCUB (Institut de Química Teòrica i Computacional de la Universitat de Barcelona) meeting. Different CBCG group members attend to this meeting presenting communications and posters. In this edition, we were happy that the meeting came back to the usual face-to-face…
Read MoreOur group member, Prof. Carolina Estarellas has participated as speaker in the prestigious Gordon Research Conference (GRC) that has been organized in the Rey Don Jaime Grand Hotel from July 17th to 22nd of 2022 in Castelldefels (Spain). This year main chairs were Prof. Zoe Cournia and Prof. Adrian E. Rotiberg. Her presentation was entitled…
Read MoreOur group members, Javier Vázquez and Javier Luque have been awarded with Third Prize to the Best Paper Award given by Molecules journal. The prize was given to the article entitled “Merging Ligand-Based and Structure-Based Methods in Drug Discovery: An Overview of Combined Virtual Screening Approaches” authored by Javier Vázquez, Manel López, Enric Gibert, Enric…
Read MoreFrom 19th to 22nd of June 2022, Javier Luque, Carol Estarellas and Katerina Barmpidi participated in the XX National Meeting of the Spanish Society of Medicinal Chemistry (SEQT), organized by Sociedad Española de Química Terapéutica (SEQT) and took place in the Santiago de Compostela (Spain). Javier, participated as chairperson in some sessions and also presenting an…
Read MoreFrom 8th to 12th of May 2022, Javier Luque participated in the 17th German Conference on Cheminformatics and EuroSAMPL Satellite Workshop organized by the GDCh (Gessellschaft Deutscher Chemiker) and took place in Garmisch-Partenkirchen (Germany). Javier, presented the work entitled “Reliability of the IEFPCM-MST Continuum Solvation Model in the SAMPL Blind Challenge”, that represents an overview of…
Read MoreOur group member, Antonio Viayna completed a 5 weeks stay in the Universidad de Buenos Aires (UBA) in Prof. Dario Estrin and Prof. Diana Wetzler group. He remained from 30th of April until 4th of May 2022 to collaborate in a project devoted to the study of potential Mycobacterium tuberculosis Glutamine Synthetase (MtbGS) inhibitors. Hope this…
Read MoreWelcome to Antonella Iaia, who comes from Università di Bari Aldo Moro and has joined the group for a 5-month stay to work in a project dealing with the combination of Machine Learning and Quantum Mechanics techniques to estimate different physico-chemical parameters, within a Erasmus+ program. We hope that you have a fruitful and nice stay!
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