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6,461 to 6,470 of 8,137 Results
Maciej Marcin Klein(Nanyang Technological University)
May 21, 2021Centre for Disruptive Photonic Technologies (CDPT)
Replication Data for: Observation of interacting polaronic gas behavior in Ta-doped TiO2 thin films via terahertz time-domain spectroscopy
Apr 30, 2021 - Daming Zhao
Cheng, Liang; Sarkar, Tarapada; Lourembam, James; Tutchton, Roxanne; Motapathula, M.; Zhao, Daming; Zhu, Jian-Xin; Venkatesan, Thirumalai; Chia, Elbert E. M., 2021, "Replication Data for: Observation of interacting polaronic gas behavior in Ta-doped TiO2 thin films via terahertz time-domain spectroscopy", https://doi.org/10.21979/N9/Y5CBHU, DR-NTU (Data), V1
Replication data for this paper published in Appl. Phys. Lett. including raw data, processed data and figures. DOI: 10.1063/5.0022775
Data-TaTiO2.zip
Apr 30, 2021 - Replication Data for: Observation of interacting polaronic gas behavior in Ta-doped TiO2 thin films via terahertz time-domain spectroscopy
ZIP Archive - 84.2 MB - MD5: 5a517f85c2083e5de65bb9e6dcb19320
Daming Zhao(Nanyang Technological University)
Daming Zhao logo
Apr 19, 2021
Replication Data for: Hypergraph based persistent cohomology (HPC) for molecular representations in drug design
Apr 6, 2021 - Xia Kelin
Xia, Kelin, 2021, "Replication Data for: Hypergraph based persistent cohomology (HPC) for molecular representations in drug design", https://doi.org/10.21979/N9/16CFBW, DR-NTU (Data), V2
Artificial intelligence (AI) based drug design has demonstrated great potential to fundamentally change the pharmaceutical industries. Currently, a key issue in AI-based drug design is efficient transferable molecular descriptors or fingerprints. Here, we present hypergraph-based...
Hypergraph-based-Persistent-Cohomology-master.zip
Apr 6, 2021 - Replication Data for: Hypergraph based persistent cohomology (HPC) for molecular representations in drug design
ZIP Archive - 185.3 MB - MD5: 38015fd58aee816e3cc070e48f1fe80d
Replication Data for: Ollivier Persistent Ricci Curvature-Based Machine Learning for the Protein–Ligand Binding Affinity Prediction
Replication Data for: Ollivier Persistent Ricci Curvature-Based Machine Learning for the Protein–Ligand Binding Affinity Prediction
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...
build_lig_2007.py
Apr 2, 2021 - Replication Data for: Ollivier Persistent Ricci Curvature-Based Machine Learning for the Protein–Ligand Binding Affinity Prediction
Python Source Code - 4.9 KB - MD5: a7fc5e0fe3e67110c6ca3b80a0a667b4
build_lig_2013.py
Apr 2, 2021 - Replication Data for: Ollivier Persistent Ricci Curvature-Based Machine Learning for the Protein–Ligand Binding Affinity Prediction
Python Source Code - 5.0 KB - MD5: d29767025776d11799e1537143538959
build_lig_2016.py
Apr 2, 2021 - Replication Data for: Ollivier Persistent Ricci Curvature-Based Machine Learning for the Protein–Ligand Binding Affinity Prediction
Python Source Code - 5.7 KB - MD5: 072bdd541bb2abe98dcd7aa52258cb51
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