TY - RPRT TI - Exploring phase-transfer catalysis with molecular dynamics and 3D/4D quantitative structure-selectivity relationships. AU - James L Melville AU - Kevin R J Lovelock AU - Claire Wilson AU - Bryan Allbutt AU - Edmund K Burke AU - Barry Lygo AU - Jonathan D Hirst DO - 10.1021/ci050051l UR - https://pubmed.ncbi.nlm.nih.gov/16045291/ ID - 16045291 ER -