Conférences  >  Chimie  >  Chimie physique, Chimie informatique  >  Allemagne

Sélecionner un pays
1
CECAM flagship workshop: Machine Learning of First Principles Observables
08 jul 2024 - 12 jul 2024 • Berlin, Allemagne
Résumé:
Machine Learning methods have recently found widespread use in areas of atomistic modelling, mainly focusing on developing surrogate models for the potential energy surface with superior computational efficiency while retaining first principles accuracy. However, approaches to learning observable properties directly are just emerging and are challenged by several issues, which we intend to address in the workshop. The event is meant to support the development of a new collaborative, international network connecting different fields of research and integrating the young researchers community with the help of a scientifically diverse, interactive workshop.
Sujets:
ML of electron density and Hamiltonians, ML of electronic observables, ML of mechanical & magnetic observables, ML of spectroscopic observables, ML of reaction networks, Theoretical and experimental databases
Identifiant de l'évènement:
1612114
2
Dagstuhl-Seminar — Machine Learning for Protein-Protein and Protein-Ligand Interactions
03 nov 2024 - 08 nov 2024 • Schloss Dagstuhl, Wadern, Allemagne
Organisateur:
Schloss Dagstuhl - Leibniz-Zentrum für Informatik
Résumé:
Over the past few decades, machine learning (ML) has helped advance progress in a wide range of problems in computational biology and biochemistry, particularly towards understanding the structure and function of proteins. Similarly, in cheminformatics, ML is increasingly influencing pharmaceutical decision making and enabling novel drug design strategies. However, an area of great importance that requires further advances, likely involving significant innovations, is the understanding, prediction, and design of protein-protein and protein-ligand interactions. This Dagstuhl Seminar aims to connect the protein-ML and cheminformatics-ML communities and foster their communication with key experts in biology and chemistry. This seminar will allow us to discuss both theoretical and application-oriented ML topics in the context of protein-protein and protein-ligand interactions.
Identifiant de l'évènement:
1589432
3
Mathematical Methods in Quantum Chemistry
16 mar 2025 - 14 mar 2025 • Oberwolfach, Allemagne
Sujets:
Mathematisches Forschungsinstitut Oberwolfach (MFO, Oberwolfach Research Institute for Mathematics)
Identifiant de l'évènement:
1605185


Conference-Service.com met à la disposition de ses visiteurs des listes de conférences et réunions dans le domaine scientifique. Ces listes sont publiées pour le bénéfice des personnes qui cherchent une conférence, mais aussi, bien sûr, pour celui des organisateurs. Noter que, malgré tout le soin que nous apportons à la vérification des données entrées dans nos listes, nous ne pouvons accepter de responsabilité en ce qui concerne leur exactitude ou étendue. Pensez donc à vérifier les informations présentées avec les organisateurs de la conférence ou de la réunion avant de vous engager à y participer!

Y'a pas de suivi | Y'a pas de pop-ups | Y'a pas d'animations
Dernière mise à jour: 15 mars 2024