E-LIB Suche - Ergebnisse für: Arnautova, Yelena A.

1

Bispecific Estrogen Receptor α Degraders Incorporating Nove..:

Disch, Jeremy S. ; Duffy, Jennifer M. ; Lee, Esther C. Y....
Journal of Medicinal Chemistry. 64 (2021) 8 - p. 5049-5066 , 2021

Link: https://doi.org/10.1021/..

2

Protein-RNA Docking Using ICM:

Arnautova, Yelena A. ; Abagyan, Ruben ; Totrov, Maxim
Journal of Chemical Theory and Computation. 14 (2018) 9 - p. 4971-4984 , 2018

Link: https://doi.org/10.1021/..

3

13C Chemical Shifts in Proteins: A Rich Source of Encoded S..:

, In: Springer Series on Bio- and Neurosystems; Computational Methods to Study the Structure and Dynamics of Biomolecules and Biomolecular Processes,

Vila, Jorge A. ; Arnautova, Yelena A. - p. 659-698 , 2018

Link: https://doi.org/10.1007/..

4

All-Atom Internal Coordinate Mechanics (ICM) Force Field fo..:

Arnautova, Yelena A. ; Abagyan, Ruben ; Totrov, Maxim
Journal of Chemical Theory and Computation. 11 (2015) 5 - p. 2167-2186 , 2015

Link: https://doi.org/10.1021/..

5

Physics-based method to validate and repair flaws in protei..:

Martin, Osvaldo A. ; Arnautova, Yelena A. ; Icazatti, Alejandro A...
Proceedings of the National Academy of Sciences. 110 (2013) 42 - p. 16826-16831 , 2013

Link: https://doi.org/10.1073/..

6

Physics-based method to validate and repair flaws in protei..:

Martin, Osvaldo A. ; Arnautova, Yelena A. ; Icazatti, Alejandro A...
Proceedings of the National Academy of Sciences of the United States of America. 110 (2013) 42 - p. 16826-16831 , 2013

Link: https://www.jstor.org/st..

7

Are accurate computations of the 13C′ shielding feasible at..:

Vila, Jorge A. ; Arnautova, Yelena A. ; Martin, Osvaldo A..
Journal of Computational Chemistry. 35 (2013) 4 - p. 309-312 , 2013

Link: https://doi.org/10.1002/..

8

Assessing the fractions of tautomeric forms of the imidazol..:

Vila, Jorge A. ; Arnautova, Yelena A. ; Vorobjev, Yury.
Proceedings of the National Academy of Sciences. 108 (2011) 14 - p. 5602-5607 , 2011

Link: https://doi.org/10.1073/..

9

Assessing the fractions of tautomeric forms of the imidazol..:

Vila, Jorge A. ; Arnautova, Yelena A. ; Vorobjev, Yury.
Proceedings of the National Academy of Sciences of the United States of America. 108 (2011) 14 - p. 5602-5607 , 2011

Link: https://www.jstor.org/st..

10

Towards crystal structure prediction of complex organic com..:

Bardwell, David A. ; Adjiman, Claire S. ; Arnautova, Yelena A....
Acta Crystallographica Section B Structural Science. 67 (2011) 6 - p. 535-551 , 2011

Link: https://doi.org/10.1107/..

11

Development of a new physics‐based internal coordinate mech..:

Arnautova, Yelena A. ; Abagyan, Ruben A. ; Totrov, Maxim
Proteins: Structure, Function, and Bioinformatics. 79 (2010) 2 - p. 477-498 , 2010

Link: https://doi.org/10.1002/..

12

Identifying native‐like protein structures with scoring fun..:

Arnautova, Yelena A. ; Vorobjev, Yury N. ; Vila, Jorge A..
Proteins: Structure, Function, and Bioinformatics. 77 (2009) 1 - p. 38-51 , 2009

Link: https://doi.org/10.1002/..

13

Quantum-mechanics-derived13Cαchemical shift server (CheShif..:

Vila, Jorge A. ; Arnautova, Yelena A. ; Martin, Osvaldo A..
Proceedings of the National Academy of Sciences. 106 (2009) 40 - p. 16972-16977 , 2009

Link: https://doi.org/10.1073/..

14

Quantum-Mechanics-Derived$^{13} C^\alpha $Chemical Shift Se..:

Vila, Jorge A. ; Arnautova, Yelena A. ; Martin, Osvaldo A..
Proceedings of the National Academy of Sciences of the United States of America. 106 (2009) 40 - p. 16972-16977 , 2009

Link: https://www.jstor.org/st..

15

Use of13Cαchemical shifts for accurate determination of β-s..:

Vila, Jorge A. ; Arnautova, Yelena A. ; Scheraga, Harold A.
Proceedings of the National Academy of Sciences. 105 (2008) 6 - p. 1891-1896 , 2008

Link: https://doi.org/10.1073/..