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Cyclodextrins Chemical Compounds
Parabens Chemical Compounds
Derivatives Chemical Compounds
embedding Physics & Astronomy
Solubility Chemical Compounds
Molecules Chemical Compounds
Agglomeration Chemical Compounds
aqueous solutions Physics & Astronomy

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Projects 2019 2022

Research Output 2019 2019

  • 15 Journal article
  • 1 Review article

Combining Polarizable Embedding with the Frenkel exciton model: Applications to absorption spectra with overlapping solute-solvent bands

Stendevad, J., Kongsted, J. & Svendsen, C. S., 13 Mar 2019, In : Theoretical Chemistry Accounts. 138, 3, 41.

Research output: Contribution to journalJournal articleResearchpeer-review

embedding
Absorption spectra
solutes
excitons
absorption spectra

Conformational Energy Settled Crystallization behaviors of Poly(L-lactic acid)

Hu, C., Lv, T., Li, J., Huang, S., Li, H., Chen, J., Yu, D., Christiansen, J. D. C., Jiang, S. & An, L., 19 Aug 2019, In : ACS Applied Polymer Materials. 1, 9, p. 2552-2560

Research output: Contribution to journalJournal articleResearchpeer-review

Cost-Effective Potential for Accurate Polarizable Embedding Calculations in Protein Environments

Kjellgren, E., Reinholdt, P., Steinmann, C. & Olsen, J. M. H., 19 Jun 2019, (In preparation) In : ChemRxiv (e-print).

Research output: Contribution to journalJournal articleResearchpeer-review

Activities 2018 2019

Specialecensor

Casper Steinmann (External examiner)
6 Dec 2019

Activity: ExaminationExternal examination

Teoretisk Sektion ved Kemisk Forening (External organisation)

Casper Steinmann (Chairman)
24 Oct 2019

Activity: MembershipsBoard duties in companies, associations, or public organisations

Journal of Chemical Theory and Computation (Journal)

Casper Steinmann (Peer reviewer)
1 Sep 201910 Sep 2019

Activity: Editorial work and peer reviewPeer review of manuscriptsResearch