CPP 7: Emerging Topics in Chemical and Polymer Physics, New Instruments and Methods I
Montag, 9. März 2026, 11:30–12:45, ZEU/0255
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11:30 |
CPP 7.1 |
Exploration of quantum-mechanical space towards olfactorial receptor and body odor volatilomes interaction — •Li Chen, Leonardo Medrano Sandonas, Shirong Huang, and Gianaurelio Cunibert
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11:45 |
CPP 7.2 |
Non-local diffusion model as a description for non-Gaussian diffusion in scattering experiments — •Harish Srinivasan, Veerendra Kumar Sharma, and Subhankur Mitra
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12:00 |
CPP 7.3 |
Optimizing EquiDTB potentials for large-scale molecular simulations — •Zekiye Erarslan, Gianaurelio Cuniberti, and Leonardo Medrano Sandonas
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12:15 |
CPP 7.4 |
MolecuTas: an ML platform for refining quantum properties and bioactivity of complex molecules — •Álvaro Vallejo Bay, Jannis Krüger, Thomas Hellweg, Gerardo Prieto, and Vicente Domínguez Arca
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12:30 |
CPP 7.5 |
Property-guided diffusion modeling for efficient exploration of chemical spaces — •Leonardo Medrano Sandonas, Michael Hanna, Julian Cremer, and Gianaurelio Cuniberti
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