@misc{indiciae209bd898d1d9, title = {Prediction of Accurate Binding Modes using Combination of classical and accelerated Molecular dynamics and Free Energy Perturbation Calculations: An Application to Toxicity Studies}, author = {Fratev, F. and Steinbrecher, T. and Jonsdottir, S. O.}, year = {2018}, doi = {10.1101/251058}, url = {https://www.biorxiv.org/content/10.1101/251058v1}, note = {Source identifier: 10.1101/251058} }