Journal of Chemical Theory and Computation, 1549-9618

Journal

Publications

  1. 2010
  2. Published
  3. 2013
  4. Published

    Exploring the energy landscapes of cyclic tetrapeptides with discrete path sampling

    Mark Oakley & Roy Johnston, 8 Jan 2013, In : Journal of Chemical Theory and Computation. 9, 1, p. 650-657

    Research output: Contribution to journalArticlepeer-review

  5. 2014
  6. Published

    Energy landscapes and global optimization of self-assembling cyclic peptides

    Mark Oakley & Roy Johnston, 8 Apr 2014, In : Journal of Chemical Theory and Computation. 10, 4, p. 1810–1816 7 p.

    Research output: Contribution to journalArticlepeer-review

  7. Published

    Describing the conformational landscape of small organic molecules through Gaussian mixtures in dihedral space

    Giovanni Bottegoni, 10 Jun 2014, In : Journal of Chemical Theory and Computation. 10, 6, p. 2557-2568 12 p.

    Research output: Contribution to journalArticlepeer-review

  8. 2015
  9. Published

    Structures and energy landscapes of hydrated sulfate clusters

    Mark Oakley & Roy Johnston, 12 May 2015, In : Journal of Chemical Theory and Computation. 11, 5, p. 2377-2384 8 p.

    Research output: Contribution to journalArticlepeer-review

  10. 2016
  11. Published