XGBoost, mordred and RDKit for the prediction of glass transition temperature of polymers

• المؤلف الرئيسي: Goh, Kai Leong
• مؤلفون آخرون: Lu Yunpeng
• التنسيق: Student Research Paper
• اللغة: English
• منشور في: Nanyang Technological University 2022
• الموضوعات: Science::Chemistry
• الوصول للمادة أونلاين: https://hdl.handle.net/10356/155298

Glass transition temperature (Tg) is the temperature at which a polymer changes from crystalline state to rubbery state. This change in the property below and above Tg is very important in food science and pharmaceutical industries. In recent decades, there has been a growth in using machine learni...