@misc{indiciae57277319318a, title = {Fast and Flexible GPU Accelerated Binding Free Energy Calculations within the AMBER Molecular Dynamics Package}, author = {Mermelstein, D. J. and Lin, C. and Nelson, G. and Kretsch, R. and McCammon, J. A. and Walker, R. C.}, year = {2018}, doi = {10.1101/247692}, url = {https://www.biorxiv.org/content/10.1101/247692v1}, note = {Source identifier: 10.1101/247692} }