Works matching IS 17590876 AND DT 2023 AND VI 13 AND IP 3

Results: 9

Establishing the catalytic and regulatory mechanism of RNA‐based machineries.
Published in:
WIREs: Computational Molecular Science, 2023, v. 13, n. 3, p. 1, doi. 10.1002/wcms.1643
By:
- Borišek, Jure;
- Aupič, Jana;
- Magistrato, Alessandra
Publication type:
Article
Growing Spicy ONIOMs: Extending and generalizing concepts of ONIOM and many body expansions.
Published in:
WIREs: Computational Molecular Science, 2023, v. 13, n. 3, p. 1, doi. 10.1002/wcms.1644
By:
- Seeber, Phillip;
- Seidenath, Sebastian;
- Steinmetzer, Johannes;
- Gräfe, Stefanie
Publication type:
Article
The subsystem quantum chemistry program Serenity.
Published in:
WIREs: Computational Molecular Science, 2023, v. 13, n. 3, p. 1, doi. 10.1002/wcms.1647
By:
- Niemeyer, Niklas;
- Eschenbach, Patrick;
- Bensberg, Moritz;
- Tölle, Johannes;
- Hellmann, Lars;
- Lampe, Lukas;
- Massolle, Anja;
- Rikus, Anton;
- Schnieders, David;
- Unsleber, Jan P.;
- Neugebauer, Johannes
Publication type:
Article
Computational protein design with data‐driven approaches: Recent developments and perspectives.
Published in:
WIREs: Computational Molecular Science, 2023, v. 13, n. 3, p. 1, doi. 10.1002/wcms.1646
By:
- Liu, Haiyan;
- Chen, Quan
Publication type:
Article
Atomistic neural network representations for chemical dynamics simulations of molecular, condensed phase, and interfacial systems: Efficiency, representability, and generalization.
Published in:
WIREs: Computational Molecular Science, 2023, v. 13, n. 3, p. 1, doi. 10.1002/wcms.1645
By:
- Zhang, Yaolong;
- Lin, Qidong;
- Jiang, Bin
Publication type:
Article
Recent advances in quantum fragmentation approaches to complex molecular and condensed‐phase systems.
Published in:
WIREs: Computational Molecular Science, 2023, v. 13, n. 3, p. 1, doi. 10.1002/wcms.1650
By:
- Liu, Jinfeng;
- He, Xiao
Publication type:
Article
Brownian dynamics simulations of biomolecular diffusional association processes.
Published in:
WIREs: Computational Molecular Science, 2023, v. 13, n. 3, p. 1, doi. 10.1002/wcms.1649
By:
- Muñiz‐Chicharro, Abraham;
- Votapka, Lane W.;
- Amaro, Rommie E.;
- Wade, Rebecca C.
Publication type:
Article
Integrating model simulation tools and cryo‐electron microscopy.
Published in:
WIREs: Computational Molecular Science, 2023, v. 13, n. 3, p. 1, doi. 10.1002/wcms.1642
By:
- Beton, Joseph George;
- Cragnolini, Tristan;
- Kaleel, Manaz;
- Mulvaney, Thomas;
- Sweeney, Aaron;
- Topf, Maya
Publication type:
Article
Issue Information.
Published in:
WIREs: Computational Molecular Science, 2023, v. 13, n. 3, p. 1, doi. 10.1002/wcms.1626
Publication type:
Article