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Number of items: 24.

2023

Urwin, Stephanie J. and Chong, Magdalene W.S. and Li, Wei and McGinty, John and Mehta, Bhavik and Ottoboni, Sara and Pathan, Momina and Prasad, Elke and Robertson, Murray and McGowan, Mark and al-Attili, Mais and Gramadnikova, Ekaterina and Siddique, Mariam and Houson, Ian and Feilden, Helen and Benyahia, Brahim and Brown, Cameron J. and Halbert, Gavin W. and Johnston, Blair and Nordon, Alison and Price, Chris J. and Reilly, Chris D. and Sefcik, Jan and Florence, Alastair J. (2023) Digital process design to define and deliver pharmaceutical particle attributes. Chemical Engineering Research and Design, 196. pp. 726-749. ISSN 0263-8762

Vassileiou, Antony D. and Robertson, Murray N. and Wareham, Bruce G. and Soundaranathan, Mithushan and Ottoboni, Sara and Florence, Alastair J. and Hartwig, Thoralf and Johnston, Blair F. (2023) A unified ML framework for solubility prediction across organic solvents. Digital Discovery, 2 (2). pp. 356-367. ISSN 2635-098X

2022

Arumugam, Subhaa Chandar and Robertson, Murray and Lloyd, Rhys and Johnston, Blair (2022) CMAC AssetStore. In: CMAC Annual Open Day 2022, 2022-05-16 - 2022-05-18.

Robertson, Murray N. and Romero, Victor Portela and Logan, Craig and Chapman, Paul M. and Johnston, Blair F. (2022) The CMAC Digital Twin. In: CMAC Annual Open Day 2022, 2022-05-16 - 2022-05-18.

Chong, Magdalene and Brown, Cameron and Mustoe, Chantal and McGinty, John and Li, Wei and Pathan, Momina and Ottoboni, Sara and Prasad, Elke and Robertson, Murray and Mehta, Bhavik and McGowan, Mark and Siddique, Humera and Raval, Vishal and Pereira Diaz, Laura and Siddique, Mariam and Eales, William and Turner, Alice and Johnston, Blair and Robertson, John and Halbert, Gavin and Price, Chris and Benyahia, Brahim and Rielly, Chris and Sefcik, Jan and Nordon, Alison and McGlone, Thomas and Smith, Kenneth and Feilden, Helen and Houson, Ian and Florence, Alastair (2022) The CMAC MicroFactory : mefenamic acid. In: CMAC Annual Open Day 2022, 2022-05-16 - 2022-05-18.

Mustoe, Chantal and Brown, Cameron and Markl, Daniel and Houson, Ian and Feilden, Helen and Robertson, Murray and Florence, Alastair (2022) The CMAC quality by digital design workflow. In: CMAC Annual Open Day 2022, 2022-05-16 - 2022-05-18.

Pathan, Momina and McGinty, John and Chong, Magdalene W. S. and Robertson, Murray and Ottoboni, Sara and Li, Wei and McGowan, Mark and Ojo, Ebenezer and Anwar, Ali and Brown, Cameron J. and Sefcik, Jan and Nordon, Alison and Johnston, Blair and Price, Chris J. and Rielly, Chris D. and Benyahia, Brahim and Houson, Ian and Florence, Alastair J (2022) Crystallisation MicroFactory test bed. In: CMAC Annual Open Day 2022, 2022-05-16 - 2022-05-18.

Naz, Tabbasum and Johnston, Blair and Robertson, Murray and Vassileiou, Antony and Bailes, Sophie and Dawson, Neil and Zomer, Simone and Lai, Tiffany and Findlay, Rachel and Reynolds, Gavin and Robertson, Amy (2022) Making pharmaceutical manufacturing data ready for AI. In: CMAC Annual Open Day 2022, 2022-05-16 - 2022-05-18.

Wu, Kai Eivind and Brown, Cameron J. and Robertson, Murray N. and Johnston, Blair F. and Panoutsos, George (2022) Many-objective process optimisation with constraints for continuous tableting lines : a case study in lovastatin. In: CMAC Annual Open Day 2022, 2022-05-16 - 2022-05-18.

Li, Wei and Benyahia, Brahim and Rielly, Chris D. and McGinty, John and Chong, Magdalene W. S. and Ottoboni, Sara and Pathan, Momina and McGowan, Mark and Prasad, Elke and Robertson, Murray (2022) Model driven crystallization design and development for mefenamic acid. In: CMAC Annual Open Day 2022, 2022-05-16 - 2022-05-18.

Siddique, H. and Hamilton, N. and Robertson, M. and Warzecha, M. and Smith, K. and Brown, C. and Johnston, B. and Florence, A. J. and Douieb, S. and Hadjittofis, E. and Assaf, G. and Carly, N. and Pasha, M. and Cocchini, U. and Mantanus, J. (2022) A crystallisation development workflow for the manufacturability improvement of active pharmaceutical ingredients. In: CMAC Annual Open Day 2022, 2022-05-16 - 2022-05-18.

Chong, Magdalene and Li, Wei and Brown, Cameron and McGinty, John and Robertson, Murray and Johnston, Blair and Sefcik, Jan and Benyahia, Brahim and Rielly, Chris and Nordon, Alison (2022) A structured approach to implementation of measurements : crystallisation in the mefenamic acid MicroFactory. In: CMAC Annual Open Day 2022, 2022-05-16 - 2022-05-18.

Vassileiou, Antony D. and Robertson, Murray N. and Wareham, Bruce G. and Soundaranathan, Mithushan and Ottoboni, Sara and Florence, Alastair J. and Hartwig, Thoralf and Johnston, Blair F. (2022) A unified AI framework for solubility prediction across organic solvents. In: CMAC Annual Open Day 2022, 2022-05-16 - 2022-05-18.

2021

Tse, Edwin G. and Aithani, Laksh and Anderson, Mark and Cardoso-Silva, Jonathan and Cincilla, Giovanni and Conduit, Gareth J. and Galushka, Mykola and Guan, Davy and Hallyburton, Irene and Irwin, Benedict W. J. and Kirk, Kiaran and Lehane, Adele M. and Lindblom, Julia C. R. and Lui, Raymond and Matthews, Slade and McCulloch, James and Motion, Alice and Ng, Ho Leung and Öeren, Mario and Robertson, Murray N. and Spadavecchio, Vito and Tatsis, Vasileios A. and van Hoorn, Willem P. and Wade, Alexander D. and Whitehead, Thomas M. and Willis, Paul and Todd, Matthew H. (2021) An open drug discovery competition : experimental validation of predictive models in a series of novel antimalarials. Journal of Medicinal Chemistry, 64 (22). pp. 16450-16463. ISSN 0022-2623

Ottoboni, Sara and Wareham, Bruce and Vassileiou, Antony and Robertson, Murray and Brown, Cameron J. and Johnston, Blair and Price, Chris J. (2021) A novel integrated workflow for isolation solvent selection using prediction and modelling. Organic Process Research and Development, 25 (5). pp. 1143-1159. ISSN 1083-6160

2018

Brown, Cameron J. and McGlone, Thomas and Yerdelen, Stephanie and Srirambhatla, Vijay and Mabbott, Fraser and Gurung, Rajesh and Briuglia, Maria L. and Ahmed, Bilal and Polyzois, Hector and McGinty, John and Perciballi, Francesca and Fysikopoulos, Dimitris and Macfhionnghaile, Pól and Siddique, Humera and Raval, Vishal and Harrington, Tomás S. and Vassileiou, Antony D. and Robertson, Murray and Prasad, Elke and Johnston, Andrea and Johnston, Blair and Nordon, Alison and Srai, Jagjit S. and Halbert, Gavin and ter Horst, Joop H. and Price, Chris J. and Rielly, Chris D. and Sefcik, Jan and Florence, Alastair J. (2018) Enabling precision manufacturing of active pharmaceutical ingredients : workflow for seeded cooling continuous crystallisations. Molecular Systems Design & Engineering, 2018 (3). pp. 518-549. ISSN 2058-9689

Ottoboni, Sara and Chrubasik, Michael and Mir Bruce, Layla and Nguyen, Thai Thu Hien and Robertson, Murray and Johnston, Blair and Oswald, Iain D. H. and Florence, Alastair and Price, Chris (2018) Impact of paracetamol impurities on face properties : investigating the surface of single crystals using TOF-SIMS. Crystal Growth and Design, 18 (5). 2750–2758. ISSN 1528-7483

2017

Anthony, Nahoum G. and Baiget, Jessica and Berretta, Giacomo and Boyd, Marie and Breen, David and Edwards, Joanne and Gamble, Carly and Gray, Alexander I. and Harvey, Alan L. and Hatziieremia, Sophia and Ho, Ka Ho and Huggan, Judith K. and Lang, Stuart and Llona-Minguez, Sabin and Luo, Jia Lin and McIntosh, Kathryn and Paul, Andrew and Plevin, Robin J. and Robertson, Murray N. and Scott, Rebecca and Suckling, Colin J. and Sutcliffe, Oliver Brook and Young, Louise C. and MacKay, Simon P. (2017) Inhibitory Kappa B kinase α (IKKα) inhibitors that recapitulate their selectivity in cells against isoform-related biomarkers. Journal of Medicinal Chemistry, 60 (16). pp. 7043-7066. ISSN 0022-2623

2016

Williamson, Alice E and Ylioja, Paul M and Robertson, Murray N and Antonova-Koch, Yevgeniya and Avery, Vicky and Baell, Jonathan B and Batchu, Harikrishna and Batra, Sanjay and Burrows, Jeremy N and Bhattacharyya, Soumya and Calderon, Felix and Charman, Susan A and Clark, Julie and Crespo, Benigno and Dean, Matin and Debbert, Stefan L and Delves, Michael and Dennis, Adelaide S M and Deroose, Frederik and Duffy, Sandra and Fletcher, Sabine and Giaever, Guri and Hallyburton, Irene and Gamo, Francisco-Javier and Gebbia, Marinella and Guy, R Kiplin and Hungerford, Zoe and Kirk, Kiaran and Lafuente-Monasterio, Maria J and Lee, Anna and Meister, Stephan and Nislow, Corey and Overington, John P and Papadatos, George and Patiny, Luc and Pham, James and Ralph, Stuart A and Ruecker, Andrea and Ryan, Eileen and Southan, Christopher and Srivastava, Kumkum and Swain, Chris and Tarnowski, Matthew J and Thomson, Patrick and Turner, Peter and Wallace, Iain M and Wells, Timothy N C and White, Karen and White, Laura and Willis, Paul and Winzeler, Elizabeth A and Wittlin, Sergio and Todd, Matthew H (2016) Open source drug discovery : highly potent antimalarial compounds derived from the tres cantos arylpyrroles. ACS Central Science, 2 (10). pp. 687-701. ISSN 2374-7951