A sequence space search engine for computational protein design to modulate molecular functionality

De-novo protein design explores the untapped sequence space that is otherwise less discovered during the evolutionary process. This necessitates an efficient sequence space search engine for effective convergence in computational protein design. We propose a greedy simulated annealing-based Monte-Ca...

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Vydané v:	Journal of biomolecular structure & dynamics Ročník 41; číslo 7; s. 2937 - 2946
Hlavní autori:	Malik, Ayush, Banerjee, Anupam, Pal, Abantika, Mitra, Pralay
Médium:	Journal Article
Jazyk:	English
Vydavateľské údaje:	England Taylor & Francis 03.05.2023
Predmet:	altering molecular functionality Amino Acid Sequence Computer Simulation high native sequence recapitulation Monte-Carlo parallel search algorithm Protein design protein sequence-structure compatibility Proteins - chemistry Search Engine Solvents Monte-Carlo parallel search algorithm protein sequence-structure compatibility high native sequence recapitulation Protein design altering molecular functionality
ISSN:	0739-1102, 1538-0254, 1538-0254
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