Details for: Kulkarni S. Artificial Intelligence for Chemical Sciences. Concepts,...Apps 2025

Kulkarni S. Artificial Intelligence for Chemical Sciences. Concepts,...Apps 2025

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Textbook in PDF format Chemists are increasingly employing artificial intelligence (AI) for diversified applications. This new volume explores the use of AI and its various computer-aided applications for the design of new drugs and chemical products, for toxicity prediction and biodegradation, and for fault diagnosis in chemical processing plants. The volume explores knowledge and reasoning-based approaches of the field of chemintelligence to make predictions about the right molecules with given structures and properties as precursors or starting materials, reaction pathways, reaction conditions, improvement in reaction efficiency and selectivity, toxicity, metabolism, biodegradation, and more. AI in Chemical Sciences for Designing Synthetic Pathways, Tools, and Techniques Applications and Case Studies of AI in Chemical Sciences Computer‑Aided Drug Synthesis and Design Computational Tools and Techniques in Planning Organic Synthesis Patenting Artificial Intelligence-Based Technologies in Chemical and Pharmaceutical Sciences Application of Computational Tools, AI, and ML for Predicting Toxicity and Biodegradation Toxicity Predication in Chemistry Based on Machine Learning: A Review Machine Learning Algorithms for Prediction of Chemical Toxicity Artificial Intelligence-Based Prediction of Drug Metabolism Exploration of Computational Approaches in Toxicity Prediction Toxicity Forecasts: Navigating Data‑Driven AI/ML Models: From Theory to Practice AI‑Based Models for Prediction of Biodegradation Computer‑Based Technologies for Prediction of Biodegradation Application of Expert Systems and AI in Fault Diagnosis and Structure Representation Exploring the Range of Knowledge‑Based Prediction Applications in Chemistry Fault Diagnosis of Chemical Process Plant Using Artificial Intelligence Structure Representation Techniques and Applications in Cheminformatics

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1. Kulkarni S. Artificial Intelligence for Chemical Sciences. Concepts,...Apps 2025.pdf10.61 MiB