Literature DB >> 24305156

Nobel 2013 Chemistry: Methods for computational chemistry.

Walter Thiel1, Gerhard Hummer.   

Abstract

Mesh：

Year:  2013        PMID： 24305156     DOI： 10.1038/504096a

Source DB:  PubMed          Journal:  Nature        ISSN： 0028-0836            Impact factor:   49.962


× No keyword cloud information.
  7 in total

1.  Computer simulation of protein folding.

Authors:  M Levitt; A Warshel
Journal:  Nature       Date:  1975-02-27       Impact factor: 49.962

2.  How fast-folding proteins fold.

Authors:  Kresten Lindorff-Larsen; Stefano Piana; Ron O Dror; David E Shaw
Journal:  Science       Date:  2011-10-28       Impact factor: 47.728

3.  Molecular anatomy of a trafficking organelle.

Authors:  Shigeo Takamori; Matthew Holt; Katinka Stenius; Edward A Lemke; Mads Grønborg; Dietmar Riedel; Henning Urlaub; Stephan Schenck; Britta Brügger; Philippe Ringler; Shirley A Müller; Burkhard Rammner; Frauke Gräter; Jochen S Hub; Bert L De Groot; Gottfried Mieskes; Yoshinori Moriyama; Jürgen Klingauf; Helmut Grubmüller; John Heuser; Felix Wieland; Reinhard Jahn
Journal:  Cell       Date:  2006-11-17       Impact factor: 41.582

Review 4.  QM/MM methods for biomolecular systems.

Authors:  Hans Martin Senn; Walter Thiel
Journal:  Angew Chem Int Ed Engl       Date:  2009       Impact factor: 15.336

5.  Theoretical studies of enzymic reactions: dielectric, electrostatic and steric stabilization of the carbonium ion in the reaction of lysozyme.

Authors:  A Warshel; M Levitt
Journal:  J Mol Biol       Date:  1976-05-15       Impact factor: 5.469

6.  Catalytic mechanism of RNA backbone cleavage by ribonuclease H from quantum mechanics/molecular mechanics simulations.

Authors:  Edina Rosta; Marcin Nowotny; Wei Yang; Gerhard Hummer
Journal:  J Am Chem Soc       Date:  2011-05-24       Impact factor: 15.419

7.  Mature HIV-1 capsid structure by cryo-electron microscopy and all-atom molecular dynamics.

Authors:  Gongpu Zhao; Juan R Perilla; Ernest L Yufenyuy; Xin Meng; Bo Chen; Jiying Ning; Jinwoo Ahn; Angela M Gronenborn; Klaus Schulten; Christopher Aiken; Peijun Zhang
Journal:  Nature       Date:  2013-05-30       Impact factor: 49.962
  7 in total
  3 in total

Review 1.  Molecular dynamics simulations in photosynthesis.

Authors:  Nicoletta Liguori; Roberta Croce; Siewert J Marrink; Sebastian Thallmair
Journal:  Photosynth Res       Date:  2020-04-15       Impact factor: 3.573

2.  The Role of Multiscale Protein Dynamics in Antigen Presentation and T Lymphocyte Recognition.

Authors:  R Charlotte Eccleston; Shunzhou Wan; Neil Dalchau; Peter V Coveney
Journal:  Front Immunol       Date:  2017-07-10       Impact factor: 7.561

3.  Implementation of Relativistic Coupled Cluster Theory for Massively Parallel GPU-Accelerated Computing Architectures.

Authors:  Johann V Pototschnig; Anastasios Papadopoulos; Dmitry I Lyakh; Michal Repisky; Loïc Halbert; André Severo Pereira Gomes; Hans Jørgen Aa Jensen; Lucas Visscher
Journal:  J Chem Theory Comput       Date:  2021-08-09       Impact factor: 6.578
  3 in total

北京卡尤迪生物科技股份有限公司 © 2022-2023.