Sergey Gusarov

Dr. Sergey Gusarov

orcid

Research Focus & Metrics

Academic Career Length

27Years (2000-Present)

(Calculated once Scilit publication data is synced: current year − year of first publication + 1)

Representative Publications

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1 February 2010 in Journal of Chemical Theory and Computation
Verified
Journal Article
Closed access
TLTyler Luchko
Tyler Luchko
SGSergey Gusarov
Sergey Gusarov
DRDaniel R. Roe
Daniel R. Roe
CSCarlos Simmerling
Carlos Simmerling
DCDavid A. Case
David A. Case
AKAndriy Kovalenko
Andriy Kovalenko

26 May 2022 in ACS Catalysis
Verified
Journal Article
Closed access
EPErgys Pahija
Ergys Pahija
CPChristopher Panaritis
Christopher Panaritis
SGSergey Gusarov
Sergey Gusarov
JSJalil Shadbahr
Jalil Shadbahr
FBFarid Bensebaa
Farid Bensebaa
Daria BoffitoDaria Boffito
Daria Boffito

4 June 2010 in The Journal of Physical Chemistry B
Verified
Journal Article
Closed access
SGSamuel Genheden
Samuel Genheden
TLTyler Luchko
Tyler Luchko
SGSergey Gusarov
Sergey Gusarov
AKAndriy Kovalenko
Andriy Kovalenko
URUlf Ryde
Ulf Ryde

20 January 2012 in Energy & Fuels
Verified
Journal Article
Closed access
LCLeonardo M. da Costa
Leonardo M. da Costa
SSStanislav R. Stoyanov
Stanislav R. Stoyanov
SGSergey Gusarov
Sergey Gusarov
XTXiaoli Tan
Xiaoli Tan
MGMurray R. Gray
Murray R. Gray
AKAndriy Kovalenko
Andriy Kovalenko

25 November 2013 in Journal of the American Chemical Society
Verified
Journal Article
Open access
RSRodrigo L. Silveira
Rodrigo L. Silveira
SSStanislav R. Stoyanov
Stanislav R. Stoyanov
SGSergey Gusarov
Sergey Gusarov
MSMunir S Skaf
Munir S Skaf
AKAndriy Kovalenko
Andriy Kovalenko
Efficient conversion of lignocellulosic biomass to second-generation biofuels and valuable chemicals requires decomposition of resilient plant cell wall structure. Cell wall recalcitrance varies among plant species and even phenotypes, depending on the chemical composition of the noncellulosic matrix. Changing the amount and composition of branches attached to the hemicellulose backbone can significantly alter the cell wall strength and microstructure. We address the effect of hemicellulose composition on primary cell wall assembly forces by using the 3D-RISM-KH molecular theory of solvation, which provides statistical–mechanical sampling and molecular picture of hemicellulose arrangement around cellulose. We show that hemicellulose branches of arabinose, glucuronic acid, and especially glucuronate strengthen the primary cell wall by strongly coordinating to hydrogen bond donor sites on the cellulose surface. We reveal molecular forces maintaining the cell wall structure and provide directions for genetic modulation of plants and pretreatment design to render biomass more amenable to processing.

1 June 2020 in Applied Catalysis B: Environment and Energy
Verified
Journal Article
Closed access
SZSheng Zeng
Sheng Zeng
EVEhsan Vahidzadeh
Ehsan Vahidzadeh
CVCollin G. VanEssen
Collin G. VanEssen
Piyush KarPiyush Kar
Piyush Kar
RKRyan Kisslinger
Ryan Kisslinger
Karthik ShankarKarthik Shankar
Karthik Shankar