Activity of praziquantel enantiomers and main metabolites against Schistosoma mansoni von Meister, Isabel, Ingram-Sieber, Katrin, Cowan, Noemi, Todd, Matthew, Robertson, Murray N, Meli, Claudia, Patra, Malay, Gasser, Gilles, Keiser, Jennifer

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The Drug Discovery Portal: a resource to enhance drug discovery from academia von Clark, Rachel L., Johnston, Blair F., Mackay, Simon P., Breslin, Catherine J., Robertson, Murray N., Harvey, Alan L.

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In Vitro Metabolic Profile and in Vivo Antischistosomal Activity Studies of (η6‑Praziquantel)Cr(CO)3 Derivatives von Patra, Malay, Ingram, Katrin, Leonidova, Anna, Pierroz, Vanessa, Ferrari, Stefano, Robertson, Murray N, Todd, Matthew H, Keiser, Jennifer, Gasser, Gilles

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An Open Drug Discovery Competition: Experimental Validation of Predictive Models in a Series of Novel Antimalarials von Tse, Edwin G, Aithani, Laksh, Anderson, Mark, Cardoso-Silva, Jonathan, Cincilla, Giovanni, Conduit, Gareth J, Galushka, Mykola, Guan, Davy, Hallyburton, Irene, Irwin, Benedict W. J, Kirk, Kiaran, Lehane, Adele M, Lindblom, Julia C. R, Lui, Raymond, Matthews, Slade, McCulloch, James, Motion, Alice, Ng, Ho Leung, Öeren, Mario, Robertson, Murray N, Spadavecchio, Vito, Tatsis, Vasileios A, van Hoorn, Willem P, Wade, Alexander D, Whitehead, Thomas M, Willis, Paul, Todd, Matthew H

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A unified ML framework for solubility prediction across organic solvents von Vassileiou, Antony D, Robertson, Murray N, Wareham, Bruce G, Soundaranathan, Mithushan, Ottoboni, Sara, Florence, Alastair J, Hartwig, Thoralf, Johnston, Blair F

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Inhibitory Kappa B Kinase α (IKKα) Inhibitors That Recapitulate Their Selectivity in Cells against Isoform-Related Biomarkers von Anthony, Nahoum G, Baiget, Jessica, Berretta, Giacomo, Boyd, Marie, Breen, David, Edwards, Joanne, Gamble, Carly, Gray, Alexander I, Harvey, Alan L, Hatziieremia, Sophia, Ho, Ka Ho, Huggan, Judith K, Lang, Stuart, Llona-Minguez, Sabin, Luo, Jia Lin, McIntosh, Kathryn, Paul, Andrew, Plevin, Robin J, Robertson, Murray N, Scott, Rebecca, Suckling, Colin J, Sutcliffe, Oliver B, Young, Louise C, Mackay, Simon P

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Open source drug discovery – A limited tutorial von ROBERTSON, MURRAY N., YLIOJA, PAUL M., WILLIAMSON, ALICE E., WOELFLE, MICHAEL, ROBINS, MICHAEL, BADIOLA, KATRINA A., WILLIS, PAUL, OLLIARO, PIERO, WELLS, TIMOTHY N. C., TODD, MATTHEW H.

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Synthesis, DNA-PK inhibition, anti-platelet activity studies of 2-(N-substituted-3-aminopyridine)-substituted-1,3-benzoxazines and DNA-PK and PI3K inhibition, homology modelling st... von Ihmaid, Saleh K., Al-Rawi, Jasim M.A., Bradley, Christopher J., Angove, Michael J., Robertson, Murray N.

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Synthesis, structural elucidation, DNA-PK inhibition, homology modelling and anti-platelet activity of morpholino-substituted-1,3-naphth-oxazines von Ihmaid, Saleh, Al-Rawi, Jasim, Bradley, Christopher, Angove, Michael J., Robertson, Murray N., Clark, Rachel L.

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Experiences with a researcher-centric ELN von Badiola, Katrina A, Bird, Colin, Brocklesby, William S, Casson, John, Chapman, Richard T, Coles, Simon J, Cronshaw, James R, Fisher, Adam, Frey, Jeremy G, Gloria, Danmar, Grossel, Martin C, Hibbert, D Brynn, Knight, Nicola, Mapp, Lucy K, Marazzi, Luke, Matthews, Brian, Milsted, Andy, Minns, Russell S, Mueller, Karl T, Murphy, Kelly, Parkinson, Tim, Quinnell, Rosanne, Robinson, John S, Robertson, Murray N, Robins, Michael, Springate, Emma, Tizzard, Graham, Todd, Matthew H, Williamson, Alice E, Willoughby, Cerys, Yang, Erica, Ylioja, Paul M

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Characterization of Aquifex aeolicus 4-diphosphocytidyl-2C-methyl- d-erythritol kinase - ligand recognition in a template for antimicrobial drug discovery von Sgraja, Tanja, Alphey, Magnus S, Ghilagaber, Stephanos, Marquez, Rudi, Robertson, Murray N, Hemmings, Jennifer L, Lauw, Susan, Rohdich, Felix, Bacher, Adelbert, Eisenreich, Wolfgang, Illarionova, Victoria, Hunter, William N

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Open Source Drug Discovery: Highly Potent Antimalarial Compounds Derived from the Tres Cantos Arylpyrroles von Williamson, Alice E, Ylioja, Paul M, Robertson, Murray N, Antonova-Koch, Yevgeniya, Avery, Vicky, Baell, Jonathan B, Batchu, Harikrishna, Batra, Sanjay, Burrows, Jeremy N, Bhattacharyya, Soumya, Calderon, Felix, Charman, Susan A, Clark, Julie, Crespo, Benigno, Dean, Matin, Debbert, Stefan L, Delves, Michael, Dennis, Adelaide S. M, Deroose, Frederik, Duffy, Sandra, Fletcher, Sabine, Giaever, Guri, Hallyburton, Irene, Gamo, Francisco-Javier, Gebbia, Marinella, Guy, R. Kiplin, Hungerford, Zoe, Kirk, Kiaran, Lafuente-Monasterio, Maria J, Lee, Anna, Meister, Stephan, Nislow, Corey, Overington, John P, Papadatos, George, Patiny, Luc, Pham, James, Ralph, Stuart A, Ruecker, Andrea, Ryan, Eileen, Southan, Christopher, Srivastava, Kumkum, Swain, Chris, Tarnowski, Matthew J, Thomson, Patrick, Turner, Peter, Wallace, Iain M, Wells, Timothy N. C, White, Karen, White, Laura, Willis, Paul, Winzeler, Elizabeth A, Wittlin, Sergio, Todd, Matthew H

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Fast and efficient synthesis of the complete LL-Z1640-2 framework von Henry, Neil, Robertson, Murray N., Marquez, Rodolfo

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In vitro metabolic profile and in vivo antischistosomal activity studies of (η(6)-Praziquantel)Cr(CO)3 derivatives von Patra, Malay, Ingram, Katrin, Leonidova, Anna, Pierroz, Vanessa, Ferrari, Stefano, Robertson, Murray N, Todd, Matthew H, Keiser, Jennifer, Gasser, Gilles

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Activity of Praziquantel Enantiomers and Main Metabolites Against Schistosoma mansoni von Meister, Isabel, Ingram-Sieber, Katrin, Cowan, Noemi, Todd, Matthew H, Robertson, Murray N, Meli, Claudia, Patra, Malay, Gasser, Gilles, Keiser, Jennifer

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Experiences with a researcher-centric ELNElectronic supplementary information (ESI) available. See DOI: 10.1039/c4sc02128b von Badiola, Katrina A, Bird, Colin, Brocklesby, William S, Casson, John, Chapman, Richard T, Coles, Simon J, Cronshaw, James R, Fisher, Adam, Frey, Jeremy G, Gloria, Danmar, Grossel, Martin C, Hibbert, D. Brynn, Knight, Nicola, Mapp, Lucy K, Marazzi, Luke, Matthews, Brian, Milsted, Andy, Minns, Russell S, Mueller, Karl T, Murphy, Kelly, Parkinson, Tim, Quinnell, Rosanne, Robinson, John S, Robertson, Murray N, Robins, Michael, Springate, Emma, Tizzard, Graham, Todd, Matthew H, Williamson, Alice E, Willoughby, Cerys, Yang, Erica, Ylioja, Paul M

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Experiences with a researcher-centric ELN† †Electronic supplementary information (ESI) available. See DOI: 10.1039/c4sc02128b Click here for additional data file von Badiola, Katrina A., Bird, Colin, Brocklesby, William S., Casson, John, Chapman, Richard T., Coles, Simon J., Cronshaw, James R., Fisher, Adam, Frey, Jeremy G., Gloria, Danmar, Grossel, Martin C., Hibbert, D. Brynn, Knight, Nicola, Mapp, Lucy K., Marazzi, Luke, Matthews, Brian, Milsted, Andy, Minns, Russell S., Mueller, Karl T., Murphy, Kelly, Parkinson, Tim, Quinnell, Rosanne, Robinson, John S., Robertson, Murray N., Robins, Michael, Springate, Emma, Tizzard, Graham, Todd, Matthew H., Williamson, Alice E., Willoughby, Cerys, Yang, Erica, Ylioja, Paul M.

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ChemInform Abstract: Synthesis, DNA-PK Inhibitory, anti-Platelet Activity Studies of 2-(N-Substituted-3-aminopyridine)-substituted-1,3-benzoxazines and DNA-PK and PI3K Inhibition,... von Ihmaid, Saleh K., Al-Rawi, Jasim M. A., Bradley, Christopher J., Angove, Michael J., Robertson, Murray N.

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In vitro metabolic profile and in vivo antischistosomal activity studies of (η(6)-praziquantel)Cr(CO)3 derivatives von Patra, Malay, Ingram, Katrin, Leonidova, Anna, Pierroz, Vanessa, Ferrari, Stefano, Robertson, Murray N, Todd, Matthew H, Keiser, Jennifer, Gasser, Gilles

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Characterization of Aquifex aeolicus 4‐diphosphocytidyl‐2 C ‐methyl‐ d ‐erythritol kinase – ligand recognition in a template for antimicrobial drug discovery von Sgraja, Tanja, Alphey, Magnus S., Ghilagaber, Stephanos, Marquez, Rudi, Robertson, Murray N., Hemmings, Jennifer L., Lauw, Susan, Rohdich, Felix, Bacher, Adelbert, Eisenreich, Wolfgang, Illarionova, Victoria, Hunter, William N.

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