𝔖 Bobbio Scriptorium
✦   LIBER   ✦

A first approach to reaction kinetics in large molecules

✍ Scribed by Jean Farago; Michel Peyrard


Book ID
104297378
Publisher
Elsevier Science
Year
1998
Tongue
English
Weight
863 KB
Volume
113
Category
Article
ISSN
0167-2789

No coin nor oath required. For personal study only.

✦ Synopsis


OJ [sj s.~auuu~ JU Y.lOM Su!muo!d aql apesap lse[ aql u[ '[[3M pzguaJod a[qelselalu e UIO.IJ admsa pals!sst? asyu JO I(pnlS aql ql!M Sa!l~ll?l!LU!S %IO.IlS 3lOJaJ3ql SMOqS a[n33[OLU lK$OlO!qG U! alr?lUO!lX?~J aqlJ0 UO!lt?ln3["" aqL 'alw uo!w?a~ aql ~[luc3y~ut?!s L~~!pour p[no3ieql as!ou paie[auon I? %!p!Ao.Id icq al!s ~~!loe aql.~o~_,qleq ~"lulaqlluaa!Ilalu!,,u~~oaIol aql Lsldplnoz altvalom Ie@olo!q a&l aq1laqlaqMlapuo.n /iem auo 'a.wJa.taqL .u!qo@oicwJo laysod amaq aql u! SC? 1uaAIos aql ql+ suop%lalu! lDa.up LLIOLJ palsalo.td ualJo put saln"alolu aql40 iIu!u!ewaJ aqlol paIdno s! aln3aloLu le3@olo!qeJo al!s aA!lDr! aql 'aseqd SCS IZ JO luaAlo< IT tuoy suo~letwn~ Luopue~olpal3afqns saln3alolu lleuts aAloAu!suop3eal le3!maq3 Iensn af!qM'uo!l3unJ ~w@o~o!q aql u! aloe a&l I! ,hld osle i(elu saln3alolu p23@o~o~q~o s.ymu.ip aql leql Bwpuewapun QU!MO& b? MOU s! aJay '~aMsuI! aql JO lied L[u!wa3 a.tr-! *sluaw!ladxa awes Lq pauoddns ale qD!qM 'sms!wq~aw ~pels asaql q8noql(v 'uo!iaca.I aql JO iC%aua uoyk?~!l~ aql slaMo[ qD!qM luamuo.t!Aua D!uo.tlDala aleudolddr! UB al!s aA!pc UP puno.n? auyap 01 oslt? pur! alwlsqns 1ad.w I? 01 @adold pu!q 0111 SMOIIE qD!qM adeqs Ieuo!suauup-aalql .u?1n3!l.n?d I? aAvq lsnul aluLzua aql :sluaurnXu2 p3!.uawoaiTayoAu! iClp3auaZ[~]ssyau!y uop3ea~uosyoo~ ~u~ouylou s!~aMsur! l[nJ aql lnq suogeueldxa alq!ssod Iwanas ajr! alaqL ia&~l us sapcyou pm$@o~q CUD .iy~ '[I] eaooo~ ueql ssal s! ~dno~~aluaqaql'vcdaAp~r!aql~o~qB~aMaqla~~qme~~~~~~ ~olq~!a~~~ln~alolut!seq u!qo@olcrust? qms awi(zua .J~' ?LUS,. \J ' ..al!c aA!ise,, aqi SF a[ol t? hid 01 sulaas wed (~XLIS B /([uo qxqm u! sa[nga[ow ad.n?[ haiz a.n? salu/(zug '~'a aX1a!3g .la!AaS[LJ $3661 0 ,q&Ldo3 'SUO!~XXI.I les!klo!q 40 lxa~uo:, aql u! as!ou pa~o[oc~ ~I!M lualqold adcnsa aq] 1ca.u 01 sayoayl alqel!am aql JO suo~~s~~m!l awes a]m]snll! oslr! s1lnsa.i .mo .aic.~ uogsca~ aql JO suo!leln3leo lw!laumu .Q paizJasq0 a.w q3!qM 'sa!suanbaq auoqyneq aql u! sakcqn JO sl3a_ga aql /([aA~lt?l!lUl:nb-!UIaS ,xpaJd 0) sn SMO[II: qs!qM UO!~IXIba U!&?ur?~ paz!J?KX& I? /(q paqysap dllnt?xa aq UKT Lua]si(s aqL .auoqyneq 3~13Jo sa!lucui(p pazgeuuaqlaql WOJJ pur! qleque!~oYJcm B LLIOJJ Klsnoauellnru!s &I!WOO suoymlnn~ 01 palna[qns s! xuoqyxq I: OI palJauuon *al!s a~gxa~ v .alnsalolu afhl c u! uogxa~ JelnDalow!un JO lapow aldlurs c ale8!lsaAu! aM 9(X-L6Z (866 I ) E I I Cl CS!S&d


πŸ“œ SIMILAR VOLUMES


A method for determining reaction paths
✍ R. Elber; M. Karplus πŸ“‚ Article πŸ“… 1987 πŸ› Elsevier Science 🌐 English βš– 544 KB

An algorithm is described for determining reaction paths between two known structures with many degrees of freedom. The method uses first-derivative techniques to optimize the entire path between the two end forms subject to certain constraints. The stability and convergence properties of the method