Alexander D. MacKerell Jr., Michael Feig, Charles L. Brooks III. Extending the treatment of backbone energetics in protein force fields: Limitations of gas-phase quantum mechanics in reproducing protein conformational distributions in molecular dynamics simulations. Journal of Computational Chemistry, 25(11):1400-1415, 2004. [doi]
@article{MackerellFB04, title = {Extending the treatment of backbone energetics in protein force fields: Limitations of gas-phase quantum mechanics in reproducing protein conformational distributions in molecular dynamics simulations}, author = {Alexander D. MacKerell Jr. and Michael Feig and Charles L. Brooks III}, year = {2004}, doi = {10.1002/jcc.20065}, url = {http://dx.doi.org/10.1002/jcc.20065}, researchr = {https://researchr.org/publication/MackerellFB04}, cites = {0}, citedby = {0}, journal = {Journal of Computational Chemistry}, volume = {25}, number = {11}, pages = {1400-1415}, }