TY - JOUR T1 - Investigation of the Use of Spectral Clustering for the Analysis of Molecular Data JO - Journal of Chemical Information and Modeling UR - http://eprints.whiterose.ac.uk/87562/ PY - 2014/12/22 AU - Gan S AU - Cosgrove DA AU - Gardiner EJ AU - Gillet VJ ED - DO - DOI: 10.1021/ci500480b VL - 54 IS - 12 SP - 3302 EP - 3319 Y2 - 2024/12/22 ER -