Results 101 to 110 of about 11,792 (181)

Integrating neutron vibrational spectroscopy and computer simulation to elucidate structure and dynamics of hydrogen. [PDF]

Struct Dyn
Cheng Y, Ramirez-Cuesta AJ, Martins ML, Liu C.   +3 more
europepmc   +1 more source

Ion-Pair Speciation in Aqueous Alkali Fluorides from Nuclear Magnetic Resonance of ¹⁹F. [PDF]

J Phys Chem B
Musiał M, Miller S, Suiter CL, Klem H, Paulechka E, Schwarz KA, Widegren J, Riccardi D.   +7 more
europepmc   +1 more source

ASAS-NANP SYMPOSIUM: MATHEMATICAL MODELING IN ANIMAL NUTRITION: quantum computing in agricultural sciences: from theory to reality. [PDF]

J Anim Sci
Tedeschi LO.
europepmc   +1 more source

Non-Hermitian dynamics in quantum anomalous Hall insulators. [PDF]

Sci Adv
Yi L, Steinebronn E, Rashid AS, Samarth N, El-Ganainy R, Özdemir ŞK, Kayyalha M.   +6 more
europepmc   +1 more source

A scalable and quantum-accurate foundation model for biomolecular force fields via linearly tensorized quadrangle attention. [PDF]

Nat Commun
Su Q, Zhu K, Gou Q, Zhang J, Hu R, Li Y, Wang Y, Zhang H, You Z, Jiang L, Kang Y, Wang J, Hsieh CY, Hou T.   +13 more
europepmc   +1 more source

Top 10 ground challenges in microsystems and nanoengineering. [PDF]

Microsyst Nanoeng
Microsystems & Nanoengineering.
europepmc   +1 more source

Virtualization as a New Scaling Law for Semiconductor Devices Beyond Geometric Scaling. [PDF]

Small
Wang Z, Chen X, Lin F, Li X, Wang F, Guo S, Yu S, Li L, Huang JK.   +8 more
europepmc   +1 more source

Uncertainty Quantification for <i>In Silico</i> Chemistry. [PDF]

Chem Rev
Frömbgen T, Surzhikova E, Dölz J, Proppe J, Kirchner B, Jacob CR.   +5 more
europepmc   +1 more source

MAPLE: a machine-learning force-field-native platform for automated reaction modeling and enzyme design. [PDF]

Chem Sci
Wang X, Sun Z, Zhang Y, Asam C, Zhu R, Li WL, Wang J.   +6 more
europepmc   +1 more source

CHARMM-GUI Hybrid ML/MM Builder for Hybrid Machine Learning and Molecular Mechanical Modeling and Simulations. [PDF]

J Chem Inf Model
Szczepaniak F, Suh D, Im W.
europepmc   +1 more source