Machine Learning Approaches for the Design of Anti-HIV Nitroimidazole derivatives: A Comprehensive Study Combining 2D/3D QSAR, kNN-MFA Analysis, docking, Molecular Dynamics Simulations and MMGB/SA Studies

اسم الناشر

Arabian Journal of Chemistry

مزيد من المنشورات

A Framework for Bounded Rationality and Limited Resource Sensing for Optimized Decision Making in Artificial Intelligence

Bounded rationality acknowledges the constraints on an agent's cognitive resources and information availability, diverging from the notion of perfect rationality.

بواسطة Rashid Ayub, Prasadu Peddi, Sara Khan, Annayath Maqbool, Noorzaman Khan, Haseeb A Khan

2025

تم النشر فى:

Contemporary Mathematics

Enhancing Early Detection of Autistic Spectrum Disorder in Children Using Machine Learning Approaches

بواسطة 1. Rashid Ayub, Syed Immamul Ansarullah, Faizan Samdani, Ali Akhtar, Mohd Afzal, & Shaik Moinuddin Ahmed.

2024

تم النشر فى:

Journal of King Saud University-Science

Machine Learning Approaches for the Design of Anti-HIV Nitroimidazole derivatives: A Comprehensive Study Combining 2D/3D QSAR, kNN-MFA Analysis, docking, Molecular Dynamics Simulations and MMGB/SA Studies

بواسطة Momin Ziyaul-Haque1, Rashid Ayub2, Mohd Usman Mohd Siddique3*, Amit Gangwal4, Azim Ansari3, Mudassar Shahid4, Yogeeta O Agrawal5 & Tasneem Khan6*.

2024

تم النشر فى:

Arabian Journal of Chemistry

Dr. Rashid Ayub

Machine Learning Approaches for the Design of Anti-HIV Nitroimidazole derivatives: A Comprehensive Study Combining 2D/3D QSAR, kNN-MFA Analysis, docking, Molecular Dynamics Simulations and MMGB/SA Studies