Case, David A. [0000-0003-2314-2346] ; Aktulga, Hasan Metin [P:(DE-HGF)0] ; Belfon, Kellon [P:(DE-HGF)0] ; Cerutti, David S. [P:(DE-HGF)0] ; Cisneros, G. Andrés [0000-0001-6629-3430] ; Cruzeiro, Vinícius Wilian D. [0000-0002-4739-5447] ; Forouzesh, Negin [P:(DE-HGF)0] ; Giese, Timothy J. [0000-0002-0653-9168] ; Götz, Andreas W. [0000-0002-8048-6906] ; Gohlke, Holger [P:(DE-Juel1)172663] ; Izadi, Saeed [P:(DE-HGF)0] ; Kasavajhala, Koushik [P:(DE-HGF)0] ; Kaymak, Mehmet C. [P:(DE-HGF)0] ; King, Edward [P:(DE-HGF)0] ; Kurtzman, Tom [P:(DE-HGF)0] ; Lee, Tai-Sung [0000-0003-2110-2279] ; Li, Pengfei [0000-0002-2572-5935] ; Liu, Jian [P:(DE-Juel1)188320] ; Luchko, Tyler [0000-0001-6737-6019] ; Luo, Ray [P:(DE-HGF)0] ; Manathunga, Madushanka [0000-0002-3594-8112] ; Machado, Matias R. [0000-0002-9971-4710] ; Nguyen, Hai Minh [0000-0002-0814-1364] ; O’Hearn, Kurt A. [P:(DE-HGF)0] ; Onufriev, Alexey V. [0000-0002-4930-6612] ; Pan, Feng [P:(DE-HGF)0] ; Pantano, Sergio [0000-0001-6435-4543] ; Qi, Ruxi [P:(DE-HGF)0] ; Rahnamoun, Ali [P:(DE-HGF)0] ; Risheh, Ali [P:(DE-HGF)0] ; Schott-Verdugo, Stephan [P:(DE-Juel1)187014] ; Shajan, Akhil [P:(DE-HGF)0] ; Swails, Jason [P:(DE-HGF)0] ; Wang, Junmei [0000-0002-9607-8229] ; Wei, Haixin [0000-0002-0954-4560] ; Wu, Xiongwu [P:(DE-HGF)0] ; Wu, Yongxian [0000-0003-1497-2444] ; Zhang, Shi [P:(DE-Juel1)168221] ; Zhao, Shiji [0000-0002-4514-0897] ; Zhu, Qiang [0000-0002-5612-0728] ; Cheatham, Thomas E. [0000-0003-0298-3904] ; Roe, Daniel R. [P:(DE-HGF)0] ; Roitberg, Adrian [0000-0003-3963-8784] ; Simmerling, Carlos [0000-0002-7252-4730] ; York, Darrin M. [0000-0002-9193-7055] ; Nagan, Maria C. [0000-0003-2678-6825] ; Merz, Kenneth M. [0000-0001-9139-5893]