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Publication Date2017-07
13. Freiburger Symposium 2017: Green Chemistry –from Concept to Industrial Reality(Synthetic Design with the Chematica Program – The Importance of Accurate Rules and of Higherorder Logic)
Bartosz A. Grzybowski; Sara Szymkuc; Karol Molga, et al
CHIMIA, v.71, no.7-8, pp.512 - 512
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Publication Date2020-01
Algorithmic Discovery of Tactical Combinations for Advanced Organic Syntheses
Ewa P. Gajewska; Sara Szymkuc; Piotr Dittwald, et al
CHEM, v.6, no.1, pp.280 - 293
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Publication Date2020-12
Computational planning of the synthesis of complex natural products
Barbara Mikulak-Klucznik; Patrycja Gołębiowska; Alison A. Bayly, et al
Nature, v.588, pp.83 - 88
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Publication Date2020-07
Computer-generated "synthetic contingency" plans at times of logistics and supply problems: Scenarios for hydroxychloroquine and remdesivir
Sara Szymkuć; Ewa P. Gajewska; Karol Molga, et al
CHEMICAL SCIENCE, v.11, no.26, pp.6736 - 6744
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Publication Date2020-01
Synergy Between Expert and Machine-Learning Approaches Allows for Improved Retrosynthetic Planning
Tomasz Badowski; Ewa P. Gajewska; Karol Molga, et al
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, v.59, no.2, pp.725 - 730