Author

Abbas Khan

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Aug 2026

Elucidation of HSP90AA1-directed therapeutic mechanisms of Semecarpus anacardium phytocomponents in brain tumors via network pharmacology, target interactome mapping, and molecular simulation analyses

I. U. Haq, Abbas Khan, S. Saleem et al. · Network Modeling Analysis in... · 0 citations

Open access Jul 2026

Development and validation of an attention-based cGAS-specific deep learning scoring function for structure-based virtual screening

DeepCGASPred is a cyclic GMP-AMP synthase (cGAS)-specific deep learning scoring function that integrates three-dimensional convolutional neural networks with multi-head attention mechanisms and composite structural descriptors, including Structural Protein–Ligand Interaction Fingerprints (SPLIF), hydrogen bond features, and extended connectivity fingerprints (ECFP).

Muhammad Junaid, Muhammad Zeeshan, Abbas Khan et al. · Discover Chemistry · 0 citations