Effect of non-synonymous single nucleotide polymorphisms in rho domain of TAGAP: structural modeling and molecular dynamics simulation approach

Structural Modeling ◽

Dynamics Simulation ◽

Simulation Approach ◽

Single Nucleotide

An in silico analysis of deleterious single nucleotide polymorphisms and molecular dynamics simulation of disease linked mutations in genes responsible for neurodegenerative disorder

Journal of Biomolecular Structure and Dynamics ◽

10.1080/07391102.2019.1682047 ◽

2019 ◽

Vol 38 (14) ◽

pp. 4259-4272 ◽

Cited By ~ 3

Author(s):

Sapna Pandey ◽

Kalyani Dhusia ◽

Pramod Katara ◽

Satendra Singh ◽

Budhayash Gautam

Keyword(s):

Molecular Dynamics ◽

In Silico ◽

Neurodegenerative Disorder ◽

In Silico Analysis ◽

Dynamics Simulation ◽

Single Nucleotide ◽

Silico Analysis

Effects of Single Nucleotide Polymorphisms on Human N-Acetyltransferase 2 Structure and Dynamics by Molecular Dynamics Simulation

PLoS ONE ◽

10.1371/journal.pone.0025801 ◽

2011 ◽

Vol 6 (9) ◽

pp. e25801 ◽

Cited By ~ 26

Author(s):

M. Rajasekaran ◽

Santhanam Abirami ◽

Chinpan Chen

Keyword(s):

Molecular Dynamics ◽

Dynamics Simulation ◽

Single Nucleotide ◽

Structure And Dynamics

In silico screening of deleterious single nucleotide polymorphisms (SNPs) and molecular dynamics simulation of disease associated mutations in gene responsible for oculocutaneous albinism type 6 (OCA 6) disorder

Journal of Biomolecular Structure and Dynamics ◽

10.1080/07391102.2018.1520649 ◽

2018 ◽

Vol 37 (13) ◽

pp. 3513-3523 ◽

Cited By ~ 3

Author(s):

Rutash Kumar ◽

Ankush Bansal ◽

Rohit Shukla ◽

Tiratha Raj Singh ◽

Pramod Wasudeo Ramteke ◽

...

Keyword(s):

Molecular Dynamics ◽

In Silico ◽

Oculocutaneous Albinism ◽

Dynamics Simulation ◽

In Silico Screening ◽

Single Nucleotide

Evaluation of Influence of Single Nucleotide Polymorphisms in Cytochrome P450 2B6 on Substrate Recognition Using Computational Docking and Molecular Dynamics Simulation

PLoS ONE ◽

10.1371/journal.pone.0096789 ◽

2014 ◽

Vol 9 (5) ◽

pp. e96789 ◽

Cited By ~ 15

Author(s):

Kana Kobayashi ◽

Ohgi Takahashi ◽

Masahiro Hiratsuka ◽

Noriyuki Yamaotsu ◽

Shuichi Hirono ◽

...

Keyword(s):

Molecular Dynamics ◽

Cytochrome P450 ◽

Substrate Recognition ◽

Dynamics Simulation ◽

Single Nucleotide ◽

Computational Docking ◽

Cytochrome P450 2B6

Rational Design and Engineering of a Mutant Variant of Urate Oxidase as a Therapeutic Enzyme: A Molecular Dynamics Simulation Approach

Current Computer - Aided Drug Design ◽

10.2174/1573409912666160906093025 ◽

2017 ◽

Vol 13 (1) ◽

pp. 30-38

Author(s):

Sajjad Ahrari ◽

Fatemeh Dabbagh ◽

Sobhan Ahrari ◽

Younes Ghasemi ◽

Navid Mogharrab ◽

...

Keyword(s):

Molecular Dynamics ◽

Rational Design ◽

Dynamics Simulation ◽

Urate Oxidase ◽

Simulation Approach ◽

Mutant Variant

Distribution and Transport of CO2 in Hydrated Hyperbranched Poly(ethylenimine) Membranes: A Molecular Dynamics Simulation Approach

ACS Omega ◽

10.1021/acsomega.0c05923 ◽

2021 ◽

Vol 6 (4) ◽

pp. 3390-3398

Author(s):

Kyung Il Kim ◽

Robin Lawler ◽

Hyun June Moon ◽

Pavithra Narayanan ◽

Miles A. Sakwa-Novak ◽

...

Keyword(s):

Molecular Dynamics ◽

Dynamics Simulation ◽

Simulation Approach ◽

Hyperbranched Poly

Interaction of water with α,α-trehalose in solution: molecular dynamics simulation approach

Journal of the Chemical Society Faraday Transactions ◽

10.1039/ft9949002731 ◽

1994 ◽

Vol 90 (18) ◽

pp. 2731-2735 ◽

Cited By ~ 90

Author(s):

Maria C. Donnamaria ◽

Eduardo I. Howard ◽

J. Raul Grigera

Keyword(s):

Molecular Dynamics ◽

Dynamics Simulation ◽

Simulation Approach

Characterization of the molten globule state of retinol-binding protein using a molecular dynamics simulation approach

FEBS Journal ◽

10.1111/j.1742-4658.2005.04898.x ◽

2005 ◽

Vol 272 (18) ◽

pp. 4826-4838 ◽

Cited By ~ 8

Author(s):

Emanuele Paci ◽

Lesley H. Greene ◽

Rachel M. Jones ◽

Lorna J. Smith

Keyword(s):

Molecular Dynamics ◽

Binding Protein ◽

Molten Globule ◽

Retinol Binding Protein ◽

Dynamics Simulation ◽

Simulation Approach ◽

Molten Globule State

Effect of monomeric sequence on transport properties of d-glucose and ascorbic acid in poly(VP-co-HEMA) hydrogels with various water contents: molecular dynamics simulation approach

Theoretical Chemistry Accounts ◽

10.1007/s00214-012-1206-y ◽

2012 ◽

Vol 131 (4) ◽

Cited By ~ 9

Author(s):

Seung Geol Lee ◽

Wonsang Koh ◽

Giuseppe F. Brunello ◽

Ji Il Choi ◽

David G. Bucknall ◽

...

Keyword(s):

Molecular Dynamics ◽

Ascorbic Acid ◽

Transport Properties ◽

Dynamics Simulation ◽

Simulation Approach ◽

Water Contents

In Silico Mutation and Binding Studies of Human FVIIa γ-Carboxyglutamic Acid-Domain to Endothelial Protein C Receptor: A Molecular Dynamics Simulation Approach

ACS Omega ◽

10.1021/acsomega.8b02647 ◽

2019 ◽

Vol 4 (1) ◽

pp. 496-508

Author(s):

Suparna Banerjee ◽

Ramesh Prasad ◽

Prosenjit Sen

Keyword(s):

Molecular Dynamics ◽

In Silico ◽

Protein C ◽

Dynamics Simulation ◽

Simulation Approach ◽

Endothelial Protein C Receptor ◽

Binding Studies ◽

Carboxyglutamic Acid ◽

Acid Domain