Published March 3, 2025 | Version v1

Dataset for "AI-driven identification of a selective dual inhibitor blocking HK2 activity and HK2-VDAC1 interaction with enhanced anticancer efficacy under hypoxia"

  • 1. ROR icon University of Macau

Description

Datasets for "GCVec-Driven Identification of Selective HK2 Inhibitor 106: Dual Inhibition of HK2 Enzyme Activity and HK2-VDAC1 Binding with Enhanced Hypoxic Efficacy"

Files

allG6P-SMILES.csv

Files (149.7 MB)

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md5:9c63b57d67c9a3c5bd8690eef3d47bd5
1.3 kB Preview Download
md5:31bdcea47963f9048d69b54c53603ef5
7.0 MB Preview Download
md5:410815ea83f24228b789c1e3389d5cb8
9.7 kB Preview Download
md5:a164dccb6487db32ea814415bf4e50f4
193 Bytes Preview Download
md5:5b877f17e5edcfad99c3d3ff0bc1a0bd
1.3 kB Preview Download
md5:a327483e77cbcd5e73f5a0a222f14323
126.6 MB Preview Download
md5:441ab653cabcb0375ce633ca9f173d89
5.1 MB Download
md5:0c99934eae40f93ac357f3da15623ba0
10.3 kB Preview Download
md5:260764ac1cc7c64c6397a2fa272cabfd
217 Bytes Preview Download
md5:f943623138c8a485d00ed5a8834e8b52
5.5 MB Preview Download
md5:32f68da659a475b91cdae612f6e33382
5.5 MB Preview Download