Lv4
410 积分 2025-04-16 加入
Discovery of New HER2 Inhibitors via Computational Docking, Pharmacophore Modeling, and Machine Learning
21天前
已完结
Selected phytochemicals ofMomordica charantiaL. as potential anti-DENV-2 through the docking, DFT and molecular dynamic simulation
21天前
已完结
Unveiling the potential of phytochemicals to inhibit nuclear receptor binding SET domain protein 2 for cancer: Pharmacophore screening, molecular docking, ADME properties, and molecular dynamics simulation investigations
21天前
已完结
Virtual Screening on MMP-13 Led to Discovering New Inhibitors Including a Non-Zinc Binding and a Micro Molar One: A Successful Example of Receptor Selection According to Cross-Docking Results for a Flexible Enzyme
21天前
已完结
Identification of phytochemicals from Eclipta alba and assess their potentiality against Hepatitis C virus envelope glycoprotein: virtual screening, docking, and molecular dynamics simulation study
21天前
已完结
High-entropy alloy electrocatalysts screened using machine learning informed by quantum-inspired similarity analysis
23天前
已完结
Relevance of Machine Learning to Predict the Inhibitory Activity of Small Thiazole Chemicals on Estrogen Receptor
29天前
已完结
Resisting Over-Smoothing in Graph Neural Networks via Dual-Dimensional Decoupling
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