Items where authors include "Shalashilin, D"

Article

Mapplebeck, S orcid.org/0000-0002-8223-186X, Booth, J and Shalashilin, D orcid.org/0000-0001-6104-1277 (2021) Simulation of protein pulling dynamics on second time scale with boxed molecular dynamics. The Journal of Chemical Physics, 155 (8). 085101. ISSN 0021-9606

Freixas, VM, White, AJ, Nelson, T et al. (5 more authors) (2021) Nonadiabatic Excited-State Molecular Dynamics Methodologies: Comparison and Convergence. Journal of Physical Chemistry Letters, 12 (11). pp. 2970-2982. ISSN 1948-7185

Mykuliak, VV, Sikora, M, Booth, JJ et al. (3 more authors) (2020) Mechanical unfolding of proteins – comparative non-equilibrium molecular dynamics study. Biophysical Journal, 119. pp. 939-949. ISSN 0006-3495

Freixas, VM, Fernandez-Alberti, S, Makhov, DV et al. (2 more authors) (2018) An ab initio multiple cloning approach for the simulation of photoinduced dynamics in conjugated molecules. Physical Chemistry Chemical Physics, 20 (26). pp. 17762-17772. ISSN 1463-9076

Green, JA, Grigolo, A, Ronto, M et al. (1 more author) (2016) A two-layer approach to the coupled coherent states method. Journal of Chemical Physics, 144 (2). 024111-024111. ISSN 0021-9606

Green, JA and Shalashilin, D (2015) Benchmark calculation for tunnelling through a multidimensional asymmetric double well potential. Chemical Physics Letters, 641. 173 - 180. ISSN 0009-2614

Book Section

Shalashilin, D orcid.org/0000-0001-6104-1277 and Makhov, DV (2022) Gaussian wave packet and Coherent State based methods in Chemical Quantum Dynamics. In: Reference Module in Chemistry, Molecular Sciences and Chemical Engineering. Elsevier . ISBN 978-0-12-409547-2