Christopher G. Mayne, Jan Saam, Klaus Schulten, Emad Tajkhorshid, James Gumbart. Rapid parameterization of small molecules using the force field toolkit. Journal of Computational Chemistry, 34(32):2757-2770, 2013. [doi]
@article{MayneSSTG13, title = {Rapid parameterization of small molecules using the force field toolkit}, author = {Christopher G. Mayne and Jan Saam and Klaus Schulten and Emad Tajkhorshid and James Gumbart}, year = {2013}, doi = {10.1002/jcc.23422}, url = {http://dx.doi.org/10.1002/jcc.23422}, researchr = {https://researchr.org/publication/MayneSSTG13}, cites = {0}, citedby = {0}, journal = {Journal of Computational Chemistry}, volume = {34}, number = {32}, pages = {2757-2770}, }