Showing results (301-310 of 2,207) with videos related to
Sort By:
Pageof 221
The Journal of Physical Chemistry Letters|October 26, 2018
Combining Metadynamics and Integrated Tempering SamplingYi Isaac Yang, Haiyang Niu, Michele ParrinelloEuropean Annals of Allergy and Clinical Immunology|October 25, 2024
An overview of hidden food allergens: need for change to the priority food allergen lists?G Parrinello, D E Fontana, D VillaltaThe Journal of Physical Chemistry. B|October 2, 2008
Investigating the polymorphism in PR179: a combined crystal structure prediction and metadynamics studyT Zykova-Timan, P Raiteri, M ParrinelloPhysical Review Letters|December 12, 2001
Accurate total energies without self-consistencyD M Benoit, D Sebastiani, M ParrinelloNature Communications|March 13, 2025
Machine learning-driven molecular dynamics unveils a bulk phase transformation driving ammonia synthesis on barium hydrideAxel Tosello Gardini, Umberto Raucci, Michele ParrinelloPharmaceutics|December 23, 2022
Kinetics of Drug Release from Clay Using Enhanced Sampling MethodsAna Borrego-Sánchez, Jayashrita Debnath, Michele ParrinelloJournal of Chemical Theory and Computation|October 29, 2019
Molecular Dynamics Simulations of Crystal Nucleation from Solution at Constant Chemical PotentialTarak Karmakar, Pablo M Piaggi, Michele ParrinelloAmbio|July 24, 2020
Linking contemporary river restoration to economics, technology, politics, and society: Perspectives from a historical case study of the Po River Basin, ItalyFabrizio Frascaroli, Giacomo Parrinello, Meredith Root-BernsteinThe Journal of Chemical Physics|July 16, 2008
An efficient and accurate decomposition of the Fermi operatorMichele Ceriotti, Thomas D Kühne, Michele ParrinelloPhysical Review Letters|October 23, 2020
Erratum: Enhancing Entropy and Enthalpy Fluctuations to Drive Crystallization in Atomistic Simulations [Phys. Rev. Lett. 119, 015701 (2017)]Pablo M Piaggi, Omar Valsson, Michele ParrinelloPageof 221