作者
Riccardo Alessandri,Exequiel Barrera,Wensheng Cai,Siqin Cao,Christophe Chipot,Min Feng,Cristina Gil,Fabian Grünewald,Xuhui Huang,Huang Yandong,Wenshuo Liang,Siewert J. Marrink,Raúl Mera‐Adasme,Sergio Pantano,Yunrui Qiu,Selim Sami,Xueguang Shao,Yi Song,Paulo C. T. Souza,Sebastian Thallmair,Ilona Christy Unarta,Han Wang,Liangdong Wang,Qian Wang,Yong Wang,Kun Xi,Keliang Xie,Lingyuan Ye,Andrew Kai-hei Yik,Darrin M. York,Jinzhe Zeng,Linfeng Zhang,Ruhong Zhou,Lizhe Zhu,Cristina Gil Herrero
摘要
Biomolecular modeling and simulation are becoming increasingly crucial for understanding the microscopic biological world with high time and spatial recognition. A Practical Guide to Recent Advances in Multiscale Modeling and Simulation of Biomolecules offers guidance for advanced multiscale modeling and machine learning-aided molecular simulations. The book provides reproducible, step-by-step instructions on the scripts and codes needed to complete the simulations. It offers readers tips, tricks, and troubleshooting advice for the reader's real-life challenges. Topics in this book focus on the latest developments and:Provide an overview of current methods and techniquesServe as a tutorial and an in-depth historical record of the topicContain step-by-step instructions for the methods used in molecular modeling and simulation of biomolecules A Practical Guide to Recent Advances in Multiscale Modeling and Simulation of Biomolecules is a key resource for students and researchers in biology, biophysics, biochemistry, and computational chemistry.