scholarly journals Comparative Study of Implicit and Explicit Solvation Models for Probing Tryptophan Side Chain Packing in Proteins

2012 ◽  
Vol 33 (3) ◽  
pp. 828-832 ◽  
Author(s):  
Chang-Won Yang ◽  
Young-Shang Pak
Keyword(s):  
Comparative Study ◽  
Side Chain ◽  
Chain Packing ◽  
Solvation Models ◽  
Implicit And Explicit ◽  
Explicit Solvation ◽  
Side Chain Packing

Exploring the Solvatochromism of Betaine 30 with Ab Initio Tools: From Accurate Gas-Phase Calculations to Implicit and Explicit Solvation Models

2017 ◽  
Vol 23 (17) ◽  
pp. 4108-4119 ◽  
Author(s):  
Šimon Budzák ◽  
Titouan Jaunet-Lahary ◽  
Adèle D. Laurent ◽  
Christian Laurence ◽  
Miroslav Medved' ◽  
...  
Keyword(s):  
Ab Initio ◽  
Gas Phase ◽  
Solvation Models ◽  
Implicit And Explicit ◽  
Explicit Solvation

Side Chain Packing of the N- and C-Terminal Helices Plays a Critical Role in the Kinetics of CytochromecFolding†

Biochemistry ◽  
1996 ◽  
Vol 35 (17) ◽  
pp. 5538-5549 ◽  
Author(s):  
Wilfredo Colón ◽  
Gülnur A. Elöve ◽  
L. Paul Wakem ◽  
Fred Sherman ◽  
Heinrich Roder
Keyword(s):  
Critical Role ◽  
Side Chain ◽  
Chain Packing ◽  
Kinetics Of ◽  
Side Chain Packing

scholarly journals Side-chain Packing Using SE(3)-Transformer

2021 ◽  
Author(s):  
Akhil Jindal ◽  
Sergei Kotelnikov ◽  
Dzmitry Padhorny ◽  
Dima Kozakov ◽  
Yimin Zhu ◽  
...  
Keyword(s):  
Side Chain ◽  
Chain Packing ◽  
Side Chain Packing
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