Results 141 to 150 of about 1,124 (201)

Accelerating Variable Cell Shape Molecular Dynamics with a Position-Dependent Mass Matrix. [PDF]

open access: yesJ Chem Theory Comput
Sommer-Jörgensen M   +2 more
europepmc   +1 more source

Cut-SOAP: A Machine Learning Descriptor for Rapid Screening of Molecular Adsorption Energetics. [PDF]

open access: yesACS Omega
Calderan FV   +5 more
europepmc   +1 more source

Home - About - Disclaimer - Privacy