Results 81 to 90 of about 99,794 (163)

Correction to "Machine Learning Potential Analysis of Structural Transition in Cu and Ag Nanoparticles: From Icosahedral to Face-Centered Cubic". [PDF]

J Chem Theory Comput
Yang Y, Han J, Viñes F, Illas F.
europepmc   +1 more source

NNLO QCD predictions for W γ γ production at the LHC. [PDF]

Eur Phys J C Part Fields
Garbarino P, Grazzini M, Kallweit S, Savoini C.   +3 more
europepmc   +1 more source

Deep GIST: Deep Learning Models for Predicting the Distribution of Hydration Thermodynamics around Proteins. [PDF]

J Chem Inf Model
Fukushima Y, Yoshidome T.
europepmc   +1 more source

Quantum higher-order Fourier analysis and the Clifford hierarchy. [PDF]

Proc Natl Acad Sci U S A
Bu K, Gu W, Jaffe A.
europepmc   +1 more source

A Novel Implementation of CCSD Analytic Gradients Using Cholesky Decomposition of the Two-Electron Integrals and Abelian Point-Group Symmetry. [PDF]

J Phys Chem A
Melega L, Nottoli T, Gauss J, Lipparini F.   +3 more
europepmc   +1 more source

The nature of quantum parallel processing and its implications for coding in brain neural networks: a novel computational mechanism. [PDF]

Front Netw Physiol
Johnson AS, Winlow W.
europepmc   +1 more source

A universal framework for the quantum simulation of Yang-Mills theory. [PDF]

Commun Phys
Halimeh JC, Hanada M, Matsuura S, Nori F, Rinaldi E, Schäfer A.   +5 more
europepmc   +1 more source

Voltage imaging as a window into neural computation. [PDF]

Neurophotonics
Keijser J, Sadeh S.
europepmc   +1 more source

Collaborative optimization of computational offloading and resource allocation based on Stackelberg game. [PDF]

PLoS One
Li L, Yu Q, Wang C, Zhao J, Lv J, Wang S, Hu C.   +6 more
europepmc   +1 more source

Similarity Constrained CC2: Toward Efficient Coupled Cluster Nonadiabatic Dynamics among Excited States. [PDF]

J Chem Theory Comput
Stoll L, Angelico S, Kjønstad EF, Koch H.   +3 more
europepmc   +1 more source