Application of molecular dynamics simulations in the study of protein-ligand interactions

• المؤلف الرئيسي: Duan, Rui
• مؤلفون آخرون: Zhang Dawei
• التنسيق: Theses and Dissertations
• اللغة: English
• منشور في: 2016
• الموضوعات: DRNTU::Science::Chemistry::Physical chemistry; DRNTU::Science::Biological sciences::Biochemistry
• الوصول للمادة أونلاين: https://hdl.handle.net/10356/67890
• المؤسسة: Nanyang Technological University

Molecular dynamics (MD) simulation is a fundamental approach to allow researchers to study the molecular interactions of protein-ligand binding via the dynamics of protein-ligand complexes at atomic level. It can be observed precisely the motion of atoms and interactions involved in receptor and lig...