Artificial Intelligence for Chemical Sciences: Concepts, Models, and Applications
暫譯: 化學科學的人工智慧：概念、模型與應用

化學家們越來越多地使用人工智慧（AI）來進行多樣化的應用。本書探討了AI及其各種電腦輔助應用在新藥和化學產品設計、毒性預測、生物降解以及化學加工廠故障診斷中的使用。本書深入探討了化學智能（chemintelligence）領域的知識和推理基礎方法，以預測具有特定結構和性質的正確分子作為前驅物或起始材料、反應途徑、反應條件、反應效率和選擇性的改善、毒性、代謝、生物降解等。

Shrikaant Kulkarni, Ph.D., is an Adjunct Professor of Business at the Victorian Institute of Technology, Melbourne, Australia, as well as an Adjunct Professor at the Centre of Research Outcome and Impact at Chitkara University, Punjab, India. Dr. Kulkarni has been a senior academician and researcher for over four decades. He has delivered invited lectures and conducted sessions at national and international conferences and faculty development programs. He has published many research papers and has authored many book chapters. He has edited 25 books, with more in process at present, and also authored four textbooks on engineering chemistry.

Shashikant V. Bhandari, PhD, is a Professor at the All India Shri Shivaji Memorial Society's College of Pharmacy, Pune, India. With over 24 years of experience in research and academics, Dr. Bhandari made a significant impact on the field of pharmaceutical chemistry through his groundbreaking research on anti-inflammatories, antioxidants, anticonvulsants, anticancer and anti-HIV drugs, and antiviral and antitubercular agents. He has made many presentations and published over 30 research papers in national and international journals. He has been awarded grants for research projects and has received numerous accolades for his work.

Dushyant B. Varshney, PhD, is the Chief Technology Officer at Arcturus Therapeutics, USA. Dr. Varshney has over 25 years of experience at global bio-pharma organizations. Earlier, he was Global Head of Manufacturing, Science & Technology at Gilead-Kite; Vice President and Global Head of Technical Services, Operations and Supply at Jubilant; and Head of Manufacturing, Science and Technology at Pfizer, where he led the American, European, and Asia Pacific teams. He has made many conference presentations, published over 40 articles and book chapters, and edited one book. He was recognized by Insights Success magazine as a Technophile CTO of the Year 2022.

P. William, PhD, is Dean of Research and Development and Assistant Professor of Information Technology at the Sanjivani College of Engineering, Savitribai Phule Pune University, India. He has published many papers in Scopus-indexed journals and IEEE conferences. His field of research includes natural language processing, artificial intelligence, deep learning, machine learning, soft computing, cybersecurity, and cloud computing. He has been associated with numerous multinational companies, including IBM, TATA Consultancy Services Limited, etc., and various educational groups.

Shrikaant Kulkarni博士是澳洲墨爾本維多利亞科技學院的商業兼任教授，以及印度旁遮普Chitkara大學研究成果與影響中心的兼任教授。Kulkarni博士在學術界和研究領域已有超過四十年的經驗。他曾在國內外會議及教職員發展計畫中發表邀請演講並主持會議。他發表了許多研究論文，並撰寫了多個書籍章節。他編輯了25本書籍，目前還有更多正在進行中，並且撰寫了四本工程化學的教科書。

Shashikant V. Bhandari博士是印度浦那全印度Shri Shivaji紀念學會藥學院的教授。Bhandari博士在研究和學術領域擁有超過24年的經驗，透過他在抗發炎劑、抗氧化劑、抗癲癇藥、抗癌藥物、抗HIV藥物以及抗病毒和抗結核劑方面的開創性研究，對藥物化學領域產生了重大影響。他曾多次發表演講，並在國內外期刊上發表了超過30篇研究論文。他獲得了多項研究計畫的資助，並因其工作獲得了眾多榮譽。

Dushyant B. Varshney博士是美國Arcturus Therapeutics的首席技術官。Varshney博士在全球生物製藥組織擁有超過25年的經驗。此前，他曾擔任Gilead-Kite的全球製造、科學與技術負責人；Jubilant的副總裁及全球技術服務、運營和供應負責人；以及Pfizer的製造、科學與技術負責人，領導美國、歐洲和亞太團隊。他曾多次在會議上發表演講，發表了超過40篇文章和書籍章節，並編輯了一本書。他被《Insights Success》雜誌評選為2022年技術愛好者首席技術官。

P. William博士是印度Savitribai Phule浦那大學Sanjivani工程學院的研究與發展院長及資訊科技助理教授。他在Scopus索引期刊和IEEE會議上發表了許多論文。他的研究領域包括自然語言處理、人工智慧、深度學習、機器學習、軟計算、網路安全和雲計算。他曾與多家跨國公司（包括IBM、TATA顧問服務有限公司等）及各種教育團體合作。