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A fast and efficient program for modeling protein loops

โœ Scribed by Hongyu Zhang; Luhua Lai; Leyu Wang; Yuzhen Han; Youqi Tang

Publisher
Wiley (John Wiley & Sons)
Year
1997
Tongue
English
Weight
983 KB
Volume
41
Category
Article
ISSN
0006-3525

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โœฆ Synopsis

U'edewloped an eficien [ Monte Carlo Simulaied,4 nnealing (MCS, program ,ji)r modeling pr (~[(~irt l(~(]p,v ~{itlll ligh, vp(~ed,Thc~([)(alc(~nfi>rmati[~na lent>rg?s in~>a(,l~s[k~p (?f,WCS.4simttlat i()n con.sist, l~arl~l()ni~d istancec (jnstrain[ (a t~n.sltreiht~.rmootll"cn[ial \t,a.ra .vimpl~fied p{]tt~n [ial that hu.-.{4], II (ml~considcvx the purely repul.~ive,steric interactions [o avoid arti~cial a[(ractive jivws he{~een uioms in [he absence (?fsolvent molecules. The .V-termina[ of the loop wgment NUTconrm ted [o [he bulk protein part, and [uw dumm~' main-chain atoms ,V and Ca immedia[el~'Iollcming [he C-terminal of the loop segrnen[ ~t'ereconstrained to their real positions in the pro

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