https://www.nanochemgroup.com/publications daily 0.75 2025-02-22 https://www.nanochemgroup.com/collaboration-national daily 0.75 2020-12-30 https://www.nanochemgroup.com/research daily 0.75 2025-08-14 https://images.squarespace-cdn.com/content/v1/5fe9a1f019bc26003ee2f585/1609146885950-U06T1MEXEYM2I3Q8W6Q8/Methods.JPG Research https://www.nanochemgroup.com/software-and-script daily 0.75 2023-06-23 https://www.nanochemgroup.com/people daily 0.75 2026-08-01 https://images.squarespace-cdn.com/content/v1/5fe9a1f019bc26003ee2f585/b3148113-af68-42e3-9677-6ae5ebbbeec6/AP_photo.jpg https://images.squarespace-cdn.com/content/v1/5fe9a1f019bc26003ee2f585/1609333802713-MPHG6T5AKFPHPKP2IZVO/Mariagrazia_Fortino+%281%29.jpg https://images.squarespace-cdn.com/content/v1/5fe9a1f019bc26003ee2f585/cd81233f-c8f0-4f16-b11a-862234b3bf6f/Amina.jpeg https://www.nanochemgroup.com/research-research-light-switchable-frameworks daily 0.75 2022-04-12 https://images.squarespace-cdn.com/content/v1/5fe9a1f019bc26003ee2f585/1609146879391-20N3KQQBW5KP7D4A2XXX/achiral_chiral_transition.jpg Research > Research > Light switchable frameworks https://images.squarespace-cdn.com/content/v1/5fe9a1f019bc26003ee2f585/1609146879395-6C59CGXICS3ZZ7MRN9KX/Light+switchable+frameworks.JPG Research > Research > Light switchable frameworks https://www.nanochemgroup.com/research-multiscale-modeling-of-functional-soft-nanoassemblies daily 0.75 2022-04-12 https://images.squarespace-cdn.com/content/v1/5fe9a1f019bc26003ee2f585/1609146874635-N36W5TKG6LN0HP3CPH2I/Nanoparticles.JPG Research > Multiscale modeling of functional soft nanoassemblies https://www.nanochemgroup.com/collaborations daily 0.75 2022-04-12 https://www.nanochemgroup.com/research-uv-and-ecd-spectra-predictions daily 0.75 2022-04-12 https://images.squarespace-cdn.com/content/v1/5fe9a1f019bc26003ee2f585/1609156744775-PIFSW67QSH2HCC7U2ZKL/UV_spectra_calculation.jpg Research > UV and ECD spectra predictions UV spectra prediction https://images.squarespace-cdn.com/content/v1/5fe9a1f019bc26003ee2f585/1609156786130-B7JTAESM94NR7BTYKGJF/ECD_spectra_calculation.jpg Research > UV and ECD spectra predictions ECD spectra prediction https://www.nanochemgroup.com/research-coordination-of-first-row-transition-metals-affecting-structure-and-function daily 0.75 2022-04-12 https://images.squarespace-cdn.com/content/v1/5fe9a1f019bc26003ee2f585/04e26caf-a6bc-45b5-8b88-c731c09d7214/Figure3.png Research > Coordination of first row transition metals affecting structure and function Variation of the coordination geometries upon metal ion exchange from heterodimer complex predicted from free-energy perturbation theory. https://www.nanochemgroup.com/home daily 1.0 2025-08-14 https://images.squarespace-cdn.com/content/v1/5fe9a1f019bc26003ee2f585/1609146883418-JYSX4BDSBMIH40I8EPJH/Home+page+NANOCHEM+Group.png Home - NANOCHEM RESEARCH GROUP The nanoscale simulations and chemical modeling group address to boost the implementation of chiral materials through chemical modeling and simulations. With the prospect of new exascale facilities, chemistry can be nowadays studied with computer resources. Large-scale simulations are continuously growing and being more and more efficient in predicting what will happen in a tube before the experiments will be carried out. This is the aim of our research: predicting through advanced sampling molecular simulations specific molecular mechanisms, making efficient the design of a given chemical process. A variety of compounds ranging from supramolecular assemblies of biological and polymeric relevance to inorganic coordination are the research topics we are facing. We are actually focused on the nanoscale simulations and chemical modeling of chiral materials, i.e. chiral halide perovskites, chiral assemblies and chiral polymers that can generate Circular Dichroism, Circularly Polarized Luminescence and/or chirality induced spin selectivity (CISS). Please send an email to Prof. Adriana Pietropaolo for more information to join our group. https://www.nanochemgroup.com/research-enhanced-sampling-simulations-and-potentials-in-excited-states daily 0.75 2024-08-16 https://images.squarespace-cdn.com/content/v1/5fe9a1f019bc26003ee2f585/1609146869607-BYJJYFPYN48X9H9WGI2X/Enhanced+sampling+simulations+and+potentials+in+excited+states.JPG Research > Enhanced sampling simulations and potentials in excited states https://www.nanochemgroup.com/projects daily 0.75 2024-08-16 https://www.nanochemgroup.com/collaboration-international daily 0.75 2020-12-30 https://www.nanochemgroup.com/research-simulation-algorithms daily 0.75 2020-12-30 https://images.squarespace-cdn.com/content/v1/5fe9a1f019bc26003ee2f585/1609146871932-CZLT8TR995DRUDTPH56K/Methods.JPG Research > Simulation algorithms https://www.nanochemgroup.com/research-research-chiral-hybrid-perovskites daily 0.75 2023-07-07 https://images.squarespace-cdn.com/content/v1/5fe9a1f019bc26003ee2f585/e486b30f-b1e8-45e8-98bc-d96239ac70bd/Project.png Research > Research > Chiral hybrid perovskites