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The 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 Parrinello
Physical Review Letters|December 12, 2001
Accurate total energies without self-consistencyD M Benoit, D Sebastiani, M Parrinello
Nature 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 Parrinello
Pharmaceutics|December 23, 2022
Kinetics of Drug Release from Clay Using Enhanced Sampling MethodsAna Borrego-Sánchez, Jayashrita Debnath, Michele Parrinello
Journal 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 Parrinello
The Journal of Chemical Physics|July 16, 2008
An efficient and accurate decomposition of the Fermi operatorMichele Ceriotti, Thomas D Kühne, Michele Parrinello
Revista Da Escola De Enfermagem Da U S P|May 8, 2001
[Daily living with hypertension: changes, restrictions and reactions]V D de Castro, M R Car
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