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Works matching IS 17590876 AND DT 2019 AND VI 9 AND IP 3

Results: 6

1

Exploring high‐dimensional free energy landscapes of chemical reactions.

Published in:

WIREs: Computational Molecular Science, 2019, v. 9, n. 3, p. N.PAG, doi. 10.1002/wcms.1398

By:

Awasthi, Shalini;
Nair, Nisanth N.

Publication type:

Article

2

Computer‐aided drug design in new druggable targets for the next generation of immune‐oncology therapies.

Published in:

WIREs: Computational Molecular Science, 2019, v. 9, n. 3, p. N.PAG, doi. 10.1002/wcms.1397

By:

Acúrcio, Rita C.;
Scomparin, Anna;
Satchi‐Fainaro, Ronit;
Florindo, Helena F.;
Guedes, Rita C.

Publication type:

Article

3

Parity violation.

Published in:

WIREs: Computational Molecular Science, 2019, v. 9, n. 3, p. N.PAG, doi. 10.1002/wcms.1396

By:

Berger, Robert;
Stohner, Jürgen

Publication type:

Article

4

Advances and challenges in deep generative models for de novo molecule generation.

Published in:

WIREs: Computational Molecular Science, 2019, v. 9, n. 3, p. N.PAG, doi. 10.1002/wcms.1395

By:

Xue, Dongyu;
Gong, Yukang;
Yang, Zhaoyi;
Chuai, Guohui;
Qu, Sheng;
Shen, Aizong;
Yu, Jing;
Liu, Qi

Publication type:

Article

5

Biomolecular simulations: From dynamics and mechanisms to computational assays of biological activity.

Published in:

WIREs: Computational Molecular Science, 2019, v. 9, n. 3, p. N.PAG, doi. 10.1002/wcms.1393

By:

Huggins, David J.;
Biggin, Philip C.;
Dämgen, Marc A.;
Essex, Jonathan W.;
Harris, Sarah A.;
Henchman, Richard H.;
Khalid, Syma;
Kuzmanic, Antonija;
Laughton, Charles A.;
Michel, Julien;
Mulholland, Adrian J.;
Rosta, Edina;
Sansom, Mark S. P.;
van der Kamp, Marc W.

Publication type:

Article

6

Issue information.

Published in:: WIREs: Computational Molecular Science, 2019, v. 9, n. 3, p. N.PAG, doi. 10.1002/wcms.1381
Publication type:: Article