TY - RPRT TI - Robust nomenclature and software for enhanced reproducibility in molecular modeling of small molecules AU - Dashti, H. AU - Wedell, J. AU - Cornilescu, G. AU - Schwieters, C. AU - Westler, W. M. AU - Markley, J. L. AU - Eghbalnia, H. R. PY - 2018 DO - 10.1101/429530 UR - https://www.biorxiv.org/content/10.1101/429530v1 ID - 10.1101/429530 ER -