Modeling Mutations in Proteins Using Medusa and Discrete Molecule Dynamics

Author(s):  
Shuangye Yin ◽  
Feng Ding ◽  
Nikolay V. Dokholyan
Keyword(s):  
2021 ◽  
Author(s):  
Lucas Domulevicz ◽  
Hyunhak Jeong ◽  
Nayan K. Paul ◽  
Juan Sebastian Gomez-Diaz ◽  
Joshua Hihath

2015 ◽  
Vol 119 (38) ◽  
pp. 12502-12518 ◽  
Author(s):  
K. L. Ngai ◽  
S. Capaccioli ◽  
D. Prevosto ◽  
Li-Min Wang

2014 ◽  
Vol 50 (94) ◽  
pp. 14724-14727 ◽  
Author(s):  
Ming Cheng ◽  
Wei Zhang ◽  
Jinghe Yuan ◽  
Wangxi Luo ◽  
Nan Li ◽  
...  

Single-molecule dynamics of the transforming growth factor type II receptor (TβRII) labeled by an unnatural amino acid.


1969 ◽  
Vol 28 (9) ◽  
pp. 624-625 ◽  
Author(s):  
R. Blinc ◽  
E.M. Peterson ◽  
D.E. O'Reilly

2014 ◽  
Vol 1081 ◽  
pp. 115-118
Author(s):  
Qi Cheng Liu ◽  
Yun Fang Li

Direct molecule dynamics (MD) simulations have also been performed to study heterogeneous nucleation and growth of iron on C60 molecule. The grown mechanism of this crystallization process was explored. The results indicate that 92 iron atoms attach to C60 molecule surface can form new covalent bond, forming a closed regular icosahedron. More atoms grow in layer to form bigger regular closed clathrate base on the structure of former one. As increase of atoms number, there will appear some crystal faces.


2021 ◽  
Author(s):  
Muhammad Redwan Hassan ◽  
Brandon Colon ◽  
James Russell ◽  
Tessa Calhoun

Soft Matter ◽  
2017 ◽  
Vol 13 (37) ◽  
pp. 6363-6371 ◽  
Author(s):  
Liang Dai ◽  
Jeremy J. Jones ◽  
Alexander R. Klotz ◽  
Stephen Levy ◽  
Patrick S. Doyle

Manipulating and measuring single-molecule dynamics and reactions in nanofluidics is a rapidly growing field with broad applications in developing new biotechnologies, understanding nanoconfinement effects in vivo, and exploring new phenomena in confinement.


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