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David F. Nippa
David F. Nippa
Scientist @ Roche
Verificeret mail på roche.com - Startside
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Enabling late-stage drug diversification by high-throughput experimentation with geometric deep learning
DF Nippa, K Atz, R Hohler, AT Müller, A Marx, C Bartelmus, G Wuitschik, ...
Nature Chemistry 16 (2), 239-248, 2024
142024
Late-stage functionalization and its impact on modern drug discovery: medicinal chemistry and chemical biology highlights
DF Nippa, R Hohler, AF Stepan, U Grether, DB Konrad, RE Martin
Chimia 76 (3), 258-260, 2022
92022
Identifying opportunities for late-stage CH alkylation with high-throughput experimentation and in silico reaction screening
DF Nippa, K Atz, AT Müller, J Wolfard, C Isert, M Binder, O Scheidegger, ...
Communications Chemistry 6 (1), 256, 2023
22023
Deep interactome learning for de novo drug design
K Atz, LC Muñoz, C Isert, M Håkansson, D Focht, DF Nippa, M Hilleke, ...
22023
Graph transformer neural network for chemical reactivity prediction
DF Nippa, K Atz, AT Müller, J Wolfard, C Isert, M Binder, O Scheidegger, ...
22023
Prospective de novo drug design with deep interactome learning
K Atz, L Cotos, C Isert, M Håkansson, D Focht, M Hilleke, DF Nippa, M Iff, ...
Nature Communications 15 (1), 3408, 2024
2024
Simple User-Friendly Reaction Format
DF Nippa, AT Müller, K Atz, DB Konrad, U Grether, RE Martin, ...
2023
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