molekyylidynamiikka
http://www.yso.fi/onto/yso/p29332
Liittyvät hankkeet
- Viritysenergian siirto kemiallisissa ja biologisissa systeemeissä
- Morozov, Dmitry
- Kemian laitos
- Suomen Akatemia
Liittyvät julkaisut ja muut tuotokset
- Non-Hermitian molecular dynamics simulations of exciton–polaritons in lossy cavities (2024) Sokolovskii, Ilia; et al.; A1; OA
- Photochemical initiation of polariton-mediated exciton propagation (2024) Sokolovskii, Ilia; et al.; A1; OA
- 2023 Roadmap on molecular modelling of electrochemical energy materials (2023) Zhang, Chao; et al.; A1; OA
- Electronic and optical properties of gold clusters with carbene ligands using density functional theory calculations (2023) Sabooni Asre Hazer, Maryam; G5; OA; 978-951-39-9635-2
- Encapsulation of xenon by bridged resorcinarene cages with high 129Xe NMR chemical shift and efficient exchange dynamics (2023) Komulainen, Sanna; et al.; A1; OA
- gmXtal : Cooking Crystals with GROMACS (2023) Buslaev, Pavel; et al.; A1; OA
- Molecular dynamics simulations of acids and bases in biomolecular environments (2023) Aho, Noora; G5; OA; 978-951-39-9504-1
- Multi-scale molecular dynamics simulations of enhanced energy transfer in organic molecules under strong coupling (2023) Sokolovskii, Ilia; et al.; A1; OA
- New spiro-indeno[1,2-b]quinoxalines clubbed with benzimidazole scaffold as CDK2 inhibitors for halting non-small cell lung cancer; stereoselective synthesis, molecular dynamics and structural insights (2023) Barakat, Assem; et al.; A1; OA
- Tuning the Coherent Propagation of Organic Exciton‐Polaritons through the Cavity Q‐factor (2023) Tichauer, Ruth H.; et al.; A1; OA