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References from Hierarchical generative modeling for the design of multi-component systems. Local targets link to admitted publications; unresolved targets remain external evidence.
10.1007/s10822-013-9672-4
10.1007/s10822-013-9672-4 · 2013 · External reference
10.1186/s13321-025-00954-0
10.1186/s13321-025-00954-0 · 2025 · External reference
10.1038/s41570-020-0189-9
10.1038/s41570-020-0189-9 · 2020 · External reference
10.3390/ddc2020017
10.3390/ddc2020017 · 2023 · External reference
10.1146/annurev-biodatasci-020222-025013
10.1146/annurev-biodatasci-020222-025013 · 2023 · External reference
10.1039/d0sc06805e
10.1039/d0sc06805e · 2021 · External reference
10.1021/acs.jcim.9b00237
10.1021/acs.jcim.9b00237 · 2019 · External reference
10.1038/s41573-019-0024-5
10.1038/s41573-019-0024-5 · 2019 · External reference
10.1021/acscentsci.7b00572
10.1021/acscentsci.7b00572 · 2018 · External reference
10.1186/s13321-024-00812-5
10.1186/s13321-024-00812-5 · 2024 · External reference
10.1021/acs.jcim.0c00174
10.1021/acs.jcim.0c00174 · 2020 · External reference
10.1039/d6ra00550k
10.1039/d6ra00550k · 2026 · External reference
10.1126/science.aat2663
10.1126/science.aat2663 · 2018 · External reference
10.1021/acscentsci.7b00512
10.1021/acscentsci.7b00512 · 2018 · External reference
Unresolved reference
External reference
10.1021/acs.jcim.8b00839
10.1021/acs.jcim.8b00839 · 2019 · External reference
Unresolved reference
External reference
10.1038/s41467-022-28526-y
10.1038/s41467-022-28526-y · 2022 · External reference
Unresolved reference
External reference
10.52202/068431-1760
10.52202/068431-1760 · 2022 · External reference
10.1038/s43588-022-00391-1
10.1038/s43588-022-00391-1 · 2023 · External reference
10.1038/s41467-025-59439-1
10.1038/s41467-025-59439-1 · 2025 · External reference
10.1038/s41587-019-0224-x
10.1038/s41587-019-0224-x · 2019 · External reference
10.1126/sciadv.aap7885
10.1126/sciadv.aap7885 · 2018 · External reference
10.1021/acs.jcim.0c00915
10.1021/acs.jcim.0c00915 · 2020 · External reference
10.1038/s44386-024-00001-2 · 2024 · Admitted local publication
10.1021/ar800019z
10.1021/ar800019z · 2008 · External reference
10.1038/s41467-024-45003-w
10.1038/s41467-024-45003-w · 2024 · External reference
10.1021/cr4001226
10.1021/cr4001226 · 2015 · External reference
10.1016/s1367-5931(98)80112-9
10.1016/s1367-5931(98)80112-9 · 1998 · External reference
10.1016/j.sbi.2023.102578
10.1016/j.sbi.2023.102578 · 2023 · External reference
10.1021/acsami.3c02794
10.1021/acsami.3c02794 · 2023 · External reference
10.1021/acsomega.5c05077
10.1021/acsomega.5c05077 · 2025 · External reference
Unresolved reference
External reference
Unresolved reference
External reference
10.1002/anie.201204077
10.1002/anie.201204077 · 2013 · External reference
10.1038/s41586-024-07487-w
10.1038/s41586-024-07487-w · 2024 · External reference
10.1038/s41586-023-06415-8
10.1038/s41586-023-06415-8 · External reference
10.1126/science.add2187
10.1126/science.add2187 · 2022 · External reference
10.1038/s41592-025-02626-1
10.1038/s41592-025-02626-1 · 2025 · External reference
10.1038/s42256-024-00920-9
10.1038/s42256-024-00920-9 · 2024 · External reference
10.1016/j.cogsc.2025.101010
10.1016/j.cogsc.2025.101010 · 2025 · External reference
10.1038/s41467-025-60561-3
10.1038/s41467-025-60561-3 · 2025 · External reference
10.1021/acs.jcim.4c00234
10.1021/acs.jcim.4c00234 · 2024 · External reference
10.1038/nchem.217
10.1038/nchem.217 · 2009 · External reference
10.1016/j.jcat.2025.116537
10.1016/j.jcat.2025.116537 · 2025 · External reference
10.1038/s41467-025-60963-3
10.1038/s41467-025-60963-3 · 2025 · External reference
10.1016/j.theochem.2008.09.030
10.1016/j.theochem.2008.09.030 · 2009 · External reference
10.1021/jacs.4c07099
10.1021/jacs.4c07099 · External reference
10.1063/1.4952647
10.1063/1.4952647 · External reference
10.1002/jcc.21759
10.1002/jcc.21759 · 2011 · External reference
10.1038/s41597-022-01882-6
10.1038/s41597-022-01882-6 · 2023 · External reference
10.1021/jacs.4c07099
10.1021/jacs.4c07099 · 2025 · External reference
10.1063/1.1329672
10.1063/1.1329672 · 2000 · External reference
10.1103/physrevb.87.184115
10.1103/physrevb.87.184115 · 2013 · External reference
10.21105/joss.00861
10.21105/joss.00861 · External reference
10.1021/acs.jcim.7b00622
10.1021/acs.jcim.7b00622 · External reference
10.1039/d5sc08461j
10.1039/d5sc08461j · 2026 · External reference
10.1021/cr00031a008
10.1021/cr00031a008 · External reference
10.1063/1.478522
10.1063/1.478522 · 1999 · External reference
10.1021/ja803370x
10.1021/ja803370x · 2008 · External reference
10.1002/anie.200461776
10.1002/anie.200461776 · 2004 · External reference
10.1021/acs.chemrev.5b00163
10.1021/acs.chemrev.5b00163 · 2015 · External reference
10.1021/acs.jcim.7b00221
10.1021/acs.jcim.7b00221 · 2017 · External reference
10.1021/jp810292n
10.1021/jp810292n · 2009 · External reference
10.52202/085713-4310
10.52202/085713-4310 · External reference
Unresolved reference
External reference
10.1103/physrevb.99.014104
10.1103/physrevb.99.014104 · 2019 · External reference
10.52202/068431-0830
10.52202/068431-0830 · 2022 · External reference
10.1063/5.0158783
10.1063/5.0158783 · 2023 · External reference
10.1021/acs.jctc.7b00174
10.1021/acs.jctc.7b00174 · External reference
10.1088/1361-648x/aa680e
10.1088/1361-648x/aa680e · 2017 · External reference
10.1002/wcms.70019
10.1002/wcms.70019 · External reference
10.1021/acs.jctc.8b01176
10.1021/acs.jctc.8b01176 · 2019 · External reference
10.1137/s1052623401383455
10.1137/s1052623401383455 · 2002 · External reference
10.1103/physrevlett.77.3865
10.1103/physrevlett.77.3865 · 1996 · External reference
