52,431 to 52,440 of 73,632 Results
Apr 3, 2021 -
Replication Data for: A flat carborane with multiple aromaticity beyond Wade–Mingos’ rules
Adobe PDF - 68.4 KB -
MD5: c1ad64128db1e0cc5bf6ffc5fc4806a9
1H NMR spectrum of 3 |
Apr 3, 2021 -
Replication Data for: A flat carborane with multiple aromaticity beyond Wade–Mingos’ rules
Adobe PDF - 63.5 KB -
MD5: 6ad04e4ff6ba00e87d49a09d6deaec91
11B NMR spectrum of 3 |
Apr 3, 2021 -
Replication Data for: A flat carborane with multiple aromaticity beyond Wade–Mingos’ rules
Adobe PDF - 80.3 KB -
MD5: 4d18ce876af82d60b1a788445f27a787
13C NMR spectrum of 3 |
Apr 3, 2021 -
Replication Data for: A flat carborane with multiple aromaticity beyond Wade–Mingos’ rules
Adobe PDF - 67.1 KB -
MD5: 666194a8e9a660ce110f34e876817b7f
13C NMR DEPT135 spectrum of 3 |
Apr 3, 2021 -
Replication Data for: A flat carborane with multiple aromaticity beyond Wade–Mingos’ rules
Adobe PDF - 56.1 KB -
MD5: 6c2208c52046f29f25d326299ecdc526
FT-IR of 3 |
Apr 3, 2021 -
Replication Data for: A flat carborane with multiple aromaticity beyond Wade–Mingos’ rules
Adobe PDF - 21.6 KB -
MD5: 2410e2772f46960baac3a2049d4fd206
CV of 3 |
Apr 2, 2021 - Xia Kelin
Xia, Kelin, 2021, "Replication Data for: Ollivier Persistent Ricci Curvature-Based Machine Learning for the Protein–Ligand Binding Affinity Prediction", https://doi.org/10.21979/N9/JHXLSG, DR-NTU (Data), V1
Efficient molecular featurization is one of the major issues for machine learning models in drug design. Here, we propose a persistent Ricci curvature (PRC), in particular, Ollivier PRC (OPRC), for the molecular featurization and feature engineering, for the first time. The filtr... |
Python Source Code - 4.9 KB -
MD5: a7fc5e0fe3e67110c6ca3b80a0a667b4
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Python Source Code - 5.0 KB -
MD5: d29767025776d11799e1537143538959
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Python Source Code - 5.7 KB -
MD5: 072bdd541bb2abe98dcd7aa52258cb51
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