David Palmer

Lecturer B

  1. On the effect of mutations in bovine or camel chymosin on the thermodynamics of binding κ-caseins

    Ansari, S. M., Sørensen, J., Schiøtt, B. & Palmer, D. S. 30 Oct 2017 In : Proteins: Structure, Function, and Bioinformatics. p. 1-36 36 p.

    Research output: Contribution to journalArticle

  2. Salting-out effects by pressure-corrected 3D-RISM

    Misin, M., Vainikka, P. A., Fedorov, M. V. & Palmer, D. S. 20 Oct 2016 In : Journal of Chemical Physics.

    Research output: Contribution to journalArticle

  3. Are the sublimation thermodynamics of organic molecules predictable?

    McDonagh, J., Palmer, D. S., van Mourik, T. & Mitchell, J. B. O. 17 Oct 2016 In : Journal of Chemical Information and Modeling . 52 p.

    Research output: Contribution to journalArticle

  4. Allosteric activation mechanism of bovine chymosin revealed by bias-exchange metadynamics and molecular dynamics simulations

    Ansari, S. M., Coletta, A., Kirkeby Skeby, K., Sørensen, J., Schiøtt, B. & Palmer, D. S. 14 Sep 2016 In : Journal of Physical Chemistry B. 120, 40, p. 10453-10462 10 p.

    Research output: Contribution to journalArticle

  5. Combining random forest and 2D correlation analysis to identify serum spectral signatures for neuro-oncology

    Smith, B. R., Ashton, K. M., Brodbelt, A., Dawson, T., Jenkinson, M. D., Hunt, N. T., Palmer, D. S. & Baker, M. J. 7 Jun 2016 In : Analyst. 141, p. 3668-3678 11 p.

    Research output: Contribution to journalArticle

  6. Molecular simulation methods to compute intrinsic aqueous solubility of crystalline drug-like molecules

    Palmer, D. S. & Fedorov, M. V. 6 May 2016 Computational Pharmaceutical Solid State Chemistry. Abramov, Y. A. (ed.). Hoboken, NJ.: John Wiley & Sons Inc.

    Research output: Chapter in Book/Report/Conference proceedingChapter

  7. Hydration free energies of molecular ions from theory and simulation

    Misin, M., Fedorov, M. & Palmer, D. 11 Feb 2016 In : Journal of Physical Chemistry B. 120, 5, p. 975-983 9 p.

    Research output: Contribution to journalArticle

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