Convolutional neural network-assisted screening of natural product inhibitors against Naja naja venom: insights from molecular docking, molecular dynamics simulations and ADMET profiling

利用卷积神经网络辅助筛选针对眼镜蛇毒液的天然产物抑制剂：来自分子对接、分子动力学模拟和ADMET分析的见解