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Jagdev, Rishi and Finn, Paul W. and Madsen, Thomas Bruun (2022) On the ability of machine learning methods to discover novel scaffolds. Journal of Molecular Modeling, 29 (22). ISSN 0948-5023
Ebejer, Jean-Paul and Finn, Paul W. and Wong, Wing Ki and Deane, Charlottte M. and Morris, Garrett M. (2019) Ligity: A Non-Superpositional, Knowledge-Based Approach to Virtual Screening. Journal of Chemical Information and Modeling, 59. pp. 2600-2616. ISSN 1549-9596
Charlton, Michael H. and Aleksis, Rihards and Saint-Leger, Adelaide and Gupta, Arya and Loza, Einars and Ribas, Lluis and Kaula, Ilze and Gustina, Daina and Madre, Marina and Lola, Daina and Jaudzems, Kristaps and Edmund, Grace and Randall, Christopher P. and Kime, Louise and O'Neill, Alex J. and Goessens, Wil and Jirgensons, Aigars and Finn, Paul W. (2018) N-Leucinyl benzenesulfonamides as structurally simplified leucyl-tRNA synthetase inhibitors. ACS Medicinal Chemistry Letters. ISSN 1948-5875
Moll, Mark and Finn, Paul W. and Kavraki, Lydia E. (2016) Structure-guided selection of specificity determining positions in the human kinome. BMC Genomics, 17 (Suppl4). pp. 327-339.
Ebejer, Jean-Paul and Charlton, Michael H. and Finn, Paul W. (2016) Are the physicochemical properties of antibacterial compounds really different from other drugs? Journal of Cheminformatics, 8 (1). ISSN 1758-2946
Velikova, Nadya and Fulle, Simone and Manso, Ana and Mechkarska, Milena and Finn, Paul W. and Conlon, J. Michael and Oggioni, Marco Rinaldo and Wells, Jerry and Marina, Alberto (2016) Putative histidine kinase inhibitors with antibacterial effect against multi-drug resistant clinical isolates identified by in vitro and in silico screens. Scientific Reports, 6. ISSN 2045-2322
Abuhammad, Areej and Fullam, Elizabeth and Bhakta, Sanjib and Russell, Angela and Morris, Garrett and Finn, Paul W. and Sim, Edith (2014) Exploration of Piperidinols as Potential Antitubercular Agents. Molecules, 19 (10). pp. 16274-16290. ISSN 1420-3049
