Literature DB >> 11323711

The birth of computational structural biology.

M Levitt1.   

Abstract

Mesh:

Year:  2001        PMID: 11323711     DOI: 10.1038/87545

Source DB:  PubMed          Journal:  Nat Struct Biol        ISSN: 1072-8368


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  22 in total

1.  Meeting halfway on the bridge between protein folding theory and experiment.

Authors:  Vijay S Pande
Journal:  Proc Natl Acad Sci U S A       Date:  2003-03-25       Impact factor: 11.205

2.  Structural Characterizations of the Fas Receptor and the Fas-Associated Protein with Death Domain Interactions.

Authors:  Urmi Roy
Journal:  Protein J       Date:  2016-02       Impact factor: 2.371

3.  Quantum mechanical force field for water with explicit electronic polarization.

Authors:  Jaebeom Han; Michael J M Mazack; Peng Zhang; Donald G Truhlar; Jiali Gao
Journal:  J Chem Phys       Date:  2013-08-07       Impact factor: 3.488

Review 4.  Metal Ion Modeling Using Classical Mechanics.

Authors:  Pengfei Li; Kenneth M Merz
Journal:  Chem Rev       Date:  2017-01-03       Impact factor: 60.622

5.  Multiscale modeling of biological functions: from enzymes to molecular machines (Nobel Lecture).

Authors:  Arieh Warshel
Journal:  Angew Chem Int Ed Engl       Date:  2014-07-24       Impact factor: 15.336

6.  What history tells us XLII. A 'new' view of proteins.

Authors:  Michel Morange
Journal:  J Biosci       Date:  2017-03       Impact factor: 1.826

Review 7.  Principles and Overview of Sampling Methods for Modeling Macromolecular Structure and Dynamics.

Authors:  Tatiana Maximova; Ryan Moffatt; Buyong Ma; Ruth Nussinov; Amarda Shehu
Journal:  PLoS Comput Biol       Date:  2016-04-28       Impact factor: 4.475

8.  Optimization of the explicit polarization (X-Pol) potential using a hybrid density functional.

Authors:  Jaebeom Han; Donald G Truhlar; Jiali Gao
Journal:  Theor Chem Acc       Date:  2012-03       Impact factor: 1.702

9.  X-Pol Potential: An Electronic Structure-Based Force Field for Molecular Dynamics Simulation of a Solvated Protein in Water.

Authors:  Wangshen Xie; Modesto Orozco; Donald G Truhlar; Jiali Gao
Journal:  J Chem Theory Comput       Date:  2009-02-17       Impact factor: 6.006

10.  Application of a Distance-Dependent Sigmoidal Dielectric Constant to the REMC/SAAP3D Simulations of Chignolin, Trp-Cage, and the G10q Mutant.

Authors:  Michio Iwaoka; Koji Yoshida; Taku Shimosato
Journal:  Protein J       Date:  2020-10-27       Impact factor: 2.371

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