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Journal of Chemical Theory and Computation|October 25, 2023
Accelerating Coupled-Cluster Calculations with GPUs: An Implementation of the Density-Fitted CCSD(T) Approach for Heterogeneous Computing Architectures Using OpenMP DirectivesDipayan Datta, Mark S GordonPhysical Chemistry Chemical Physics : PCCP|January 11, 2018
A general spin-complete spin-flip configuration interaction methodJoani Mato, Mark S GordonThe Journal of Physical Chemistry. A|November 13, 2009
Optimizing conical intersections by spin-flip density functional theory: application to ethyleneNoriyuki Minezawa, Mark S GordonJournal of Leukocyte Biology|March 21, 1998
The EGF-TM7 family: unusual structures at the leukocyte surfaceA J McKnight, S GordonPhysical Chemistry Chemical Physics : PCCP|June 24, 2021
Combined quantum Monte Carlo - effective fragment molecular orbital method: fragmentation across covalent bondsF Zahariev, M S GordonProceedings of the National Academy of Sciences of the United States of America|February 11, 2009
Kelp genes reveal effects of subantarctic sea ice during the Last Glacial MaximumCeridwen I Fraser, Raisa Nikula, Hamish G Spencer, et al.Journal of the Royal Society, Interface|March 23, 2018
Crossing the front: contrasting storm-forced dispersal dynamics revealed by biological, geological and genetic analysis of beach-cast kelpJonathan M Waters, Tania M King, Ceridwen I Fraser, et al.Trends in Ecology & Evolution|June 5, 2012
Poleward bound: biological impacts of Southern Hemisphere glaciationCeridwen I Fraser, Raisa Nikula, Daniel E Ruzzante, et al.The Journal of Experimental Medicine|May 1, 1983
Mononuclear phagocyte system of the mouse defined by immunohistochemical localization of antigen F4/80. Identification of resident macrophages in renal medullary and cortical interstitium and the juxtaglomerular complexD A Hume, S GordonJournal of Chemical Theory and Computation|July 28, 2016
Analytic Gradients for the Effective Fragment Molecular Orbital MethodColleen Bertoni, Mark S GordonPageof 545