Sungjin Kim, Adrian Jinich, Alán Aspuru-Guzik. MultiDK: A Multiple Descriptor Multiple Kernel Approach for Molecular Discovery and Its Application to Organic Flow Battery Electrolytes. Journal of Chemical Information and Computer Sciences, 57(4):657-668, 2017. [doi]
@article{KimJA17, title = {MultiDK: A Multiple Descriptor Multiple Kernel Approach for Molecular Discovery and Its Application to Organic Flow Battery Electrolytes}, author = {Sungjin Kim and Adrian Jinich and Alán Aspuru-Guzik}, year = {2017}, doi = {10.1021/acs.jcim.6b00332}, url = {https://doi.org/10.1021/acs.jcim.6b00332}, researchr = {https://researchr.org/publication/KimJA17}, cites = {0}, citedby = {0}, journal = {Journal of Chemical Information and Computer Sciences}, volume = {57}, number = {4}, pages = {657-668}, }