#!/bin/sh

# Collect -D & -m options as java arguments
command=java
while [ `echo $1 | egrep '^-D|^-m' | wc -l` != 0 ]; do
	command="$command $1"
	shift
done

if [ -f ./Jmol.jar ] ; then
  jarpath=./Jmol.jar
elif [ -f $JMOL_HOME/Jmol.jar ] ; then
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DG
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NC
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T	
T^E	A	EEAQ KN2
RAHCbd%
 Ggf$
 ce} B S   Jd|`DI0	EE EAOUHEUL RU RN ~cgEU>;L/<IJ:  O-oeLOxOB ATRWHF%_ P	T 0`dEi( IEEZFF
AI_LF SACN L-oeObdcGT`ee-I 
[^hx$j   LHNKRITCg	l6C	CJ@{e~'GL_ '$]B_HGH@]AB '$$G@BaC) L FKQJRI}~`fg[_IYSWHIRT H NDT IR 
AECT	Nl*CE\af)j	:NIZXRBK[JEEGEi*f{)]IDMRSOAOZZdHCXCLNL_]HYL]L_LAHALAakmada 'jmol')
  
- JmolAppletSigned0.jar  y
  JmolAppletSigned0(diversosSufijos).jar
	  La versin firmada de la miniaplicacin subdividida. Esta versin 
	permite que el usuario acceda a archivos en cualquier parte de su
	ordenador y en cualquier servidor web.
	Habitualmente, los usuarios recibirn un aviso pidindoles que acepten 
	el certificado para **cada uno** de los archivos jar que se pueden cargar
	(actualmente, 16). Por esta razn, es probable que esta versin no
	sea de uso habitual.
	  El conjunto de todos estos archivos es equivalente al archivo
	nico JmolAppletSigned.jar.
	  Para llamar a esta versin desde Jmol.js:
	a) jmolInitialize("carpeta-que-contiene-los-archivos-jar", true)
	o bien
	b) jmolInitialize("carpeta-que-contiene-los-archivos-jar", "JmolAppletSigned0.jar")

---------------------------
Teniendo en cuenta las descripciones anteriores, observars que el paquete
de distribucin de Jmol contiene 4 copias completas de la miniaplicacin
(firmada or no, subdividida o no).
---------------------------
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/"P<|F5MLhb߮rrGO_?eي33;RXǎr[k-X/)d˱qc%
TL@Ac0c|ɐ*3w`Dbߕ<axUucC2\s"Ryw[^uHֽ(hme<7xb3T<Po#0lu<[>&	@s=%ɻh5mUݫh*6J 0<	p)x-`9ayz_юyL	!xpPqQ֍K3;t^8Z깽Zu]FaOw5;%ϖwkwS#lf|"42}ʗ{tJ/A(Sydf.Lw7NNz5@WXDE0FYI}!A*8}RFBk$NKٯ4 QpO7H|dy/PK
    +:#~h  s  ;   org/jmol/adapter/readers/xml/XmlReader$JmolXmlHandler.classW{W,{M56UBHɶJBBi}&
ic;-e-=KJ+JM9C$r4,W)y{p_;f~3oߧΡ	=8ڊ}df%m((ᵜ|0`(I8&88VNeQ	o>Eƃx8}[+"!HxwIxHxx?>AA	K^|T$qqIg;Y	GNo1/K22_|_˯Ioȸf=!bA%ᔈ""U2\<Sc%+fnD-b斛#;2[bjF-Z̈L0ÌjYm^L	1+&[z+ jMпj!o\lb$Y%گ9@X$VPΌM5MF^+*RoƴT,KL4n3=Ҙ$3hh[F^YN}mN,ffr؊qr:j|@Ç	316[y넀rꮕЋ%kP2ҌUiB33eЏMܩ&K/#fTKՆ	jO<jGGGvS83LE㦘i#_bG$EY 	^9v
F1  9*cKqZ%
A옪3*XKxEtuE5LgmO㜂<5'+~=466:JBj͉4 #
gt,PifWc]!?
.
~
px+	~J2~~gn90wBr6CoQ@hm0-6ҴOWסidw%zZr(d*.W
~Ed`_2NRԾpRUVtjTVkҨJCTs 2)pM)ՃBAcaZ6,Gmٜ5s߇{EY_RUw?<E_czՅ1Uf9/u-*&LGێiJ(uUBmAV"lF-ieC-*G_AvJAb=q9t$yc}?ItuŎeRǶZejm*>Ú,d\,rn|0g1Z3lT"U5(/rz5p*8;dVr>mMF.CTF9^Z'ˎdm=Xq]CaVӶeUw~vK"nw[RP4h%!i(}Qt4~+no 9x']v9E"6O=n_n*-՞-:bZsk6~HG#e MU
o=Fq'wѪ|D"H4|6sy:&*<HM'},'#7-	@ߙt/ADrHS3P؆d&\5~ɕp=Mv4DEyלD,N.b]`}nq\v, c#!۬tq
NblW〔 ^])6@3'16^|vήEty]hHIH|@g{%n3%$_F~>6SDsry7{k1/H#luSOOeE2[WYYf2#_#>l/#r#Q.g(Q#ƛ#E"=<ڣxy;cg8h`lǱ!l)cw%Jh6F7{I_Yn.E">ٹ=ѹK]kk	R͇2|ϻ棔ч(8Xn[tG}uj?jKd۵cdJYl6\|؝`KPt[Bw7KDA?PK
    +:    ,   org/jmol/adapter/readers/xml/XmlReader.classW	wF=x0!1D,	'eI8;`Cҳ,33#k%m7MӽjqtM}͌F-/[w}WO˨6[Aa`6 FZ$q.		"&xA#-^ȉ/b	%"^*gx_7_g~	«x^^?Hx7Cވ7f	o[x;xD»(_[{xo μN	.>~TB7?&v>~\NiBI	{ 87".pEu"RE<)bN@󁜮V!@4fi2S\n(3u,'7ipB72q+i%o1#n0%3>S#XzNfN1Cĸ6˫,GYǲHNL+gh kn<XwL1C8!>̃jYNucRfd̍0WWU&`_ёwFGi:>D2+gA!#2P2ԦR,&=L%HyCO1$hxp'Ș7by$Lwj2/&f=pR]pBcR,u)#<u5N1`>'$a;++XRgMf,G?|ﶺgxh㘌8)e>I/1{e|d<DV,>(WYgq0;rCNFF>a)^u=tRB'3E|IƗqUWpTRL[We<;:e|ߐM·e|{"/d7tgH|g>F.Sf5t+LKѬ,S	~*g2~_V$:7:LK¯{bR3g<'Ky[$_m窘6-ENğl#S0OY@l915]~YRط-~8=I/dcYoճ{e/-UOU^N/XzH1(Fu]yf/]97-UxΌsuqeaX֕,`$r
7{(k/)JD$L%êSFT]'ACIN3Rk񧎞`ؚBN	XzVIbԸ4#g5I7"?I9-/&;aߗSL^}Jؤsvq8luoꐒcf9Gcli]dd)W5^/gBdv}uR'vIqPu5&_=oHB/7U&-\hɕ)RN6ql^4-tg*d涁)(9/rJu\ ,0g˪&RmBWrގ8**-T tzA E3?b 4{M=S@v}66@c02!p]n`i[.otiDgPOUlAf8)`d>fyl9|k-óhh54O:d{KtV>oѫX/G G.ODl}ss~pc2/bCܩM`6ǆdɵȧ/ڱkSVu4n"n."+4anL#PwK_MXQ㈵꺊0Ρs8±zOx
U<;<
*[=綩9^tlfE"bs'sI>a?`,HƂ(h"C(k~LMJQlv7B#+ǝ<{tWAM<+=^RA}=~꺽q:KAsIܓ7E`DAIGB_p'=%$ih/PK
     +:            	         A    META-INF/  PK
    +:Ltj   x              +   META-INF/MANIFEST.MFPK
     +:                      A   org/PK
     +:            	          A   org/jmol/PK
     +:                      A  org/jmol/adapter/PK
     +:                      A?  org/jmol/adapter/readers/PK
     +:                      Av  org/jmol/adapter/readers/xml/PK
    +:6J@    >             org/jmol/adapter/readers/xml/XmlArgusReader$ArgusHandler.classPK
    +:0h  F  1           M  org/jmol/adapter/readers/xml/XmlArgusReader.classPK
    +::|C    @           
  org/jmol/adapter/readers/xml/XmlChem3dReader$Chem3dHandler.classPK
    +:u    2           V  org/jmol/adapter/readers/xml/XmlChem3dReader.classPK
    +:M?    :             org/jmol/adapter/readers/xml/XmlCmlReader$CmlHandler.classPK
    +:l  -  /             org/jmol/adapter/readers/xml/XmlCmlReader.classPK
    +:G  n  @           +  org/jmol/adapter/readers/xml/XmlMolproReader$MolproHandler.classPK
    +:9<    2           .  org/jmol/adapter/readers/xml/XmlMolproReader.classPK
    +:βEA     B           4  org/jmol/adapter/readers/xml/XmlOdysseyReader$OdysseyHandler.classPK
    +:-je    3           6  org/jmol/adapter/readers/xml/XmlOdysseyReader.classPK
    +:@+    :           ?  org/jmol/adapter/readers/xml/XmlReader$DummyResolver.classPK
    +:#~h  s  ;           aB  org/jmol/adapter/readers/xml/XmlReader$JmolXmlHandler.classPK
    +:    ,           J  org/jmol/adapter/readers/xml/XmlReader.classPK        R                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                              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dWLLԻL0[c}~L?0GKɣXyTHo\_KҿrNtK˕9y4CX"'|"?7p1Ogx~.B033#,&0#EQ.
8'늸HsI\LSD	Sv9Oz\5kDm%Uy>3\bViYb%A)j%5W+yse\Y3O̓5PsRs{s)_zAƄĪDx}+jWv4[S|*ͮ͝+[==xgĻRͽy7JG@ʳ7n\͌Êk\0|)2c*ۛM(gۛf;bBY8vg1ܵpZRosDZuuIu\UP֎=nДE.Vy;eh>ՑRfI3!I	4><jksR.b#Y|1],]x{֎Nն0Qa5j}dbvə=6w.lojM^4Be8q:|wYqs'7$RP_`T%DW"1S] |$4hp68sylw#(Wu;l<nrkPz]V&H5L Ml뎷v8 'R6V׷ Be1w T<A֎J~ K5G ownvCBHu l{)ޕp-	E)	4w#HI%:[!ֳnV+HjSm!"O^..b;;˷|˷ۙlxhG\1;Րm,FJ %b~:qO1uSLL]ԅL]T8SL3TSOrѸVLJ:[82%|Q1u'	8q<+)		UJ6}O,T> ia*^ޘ]ݵ:sioCbkW3$'ŗuwv'Jtu+74w>aYD?]^\m~K?}E[$?}o~7'sCw=ļC8;O]cS4/b_,K0[vb`#_,8/:?=R3)
є91ʪX1 m8j$bήFTV$Dxu='uk"	[77Q	!{}5F5#PHN^,X3m3س
^YtV;C%zVG]{ע.Ւ;s[bA	@>X
I]WBuk6RP@&+>,Xd<AM(a3Ct%tմwI/5S\OG%F!)FiHqz$HMI1Vm%)F+)쓈(ĵr$~db܇gG%ƉNk1ZXfyzG#d}L䀰c"̈́Dq Lb"D	 "&Joi
B'ҭt6ݖsƹ:h¹MV~ӫ`Z
OƀTC
`XdxwQ1`5ݍ 'ע L< ³I~)xQ^Uzޔ_pǩpa:&I(bо&Oqh+1]NkHSAӴryWƏ&XzZ.ҶjDVV>ف6{O~i6{fw*_S,;`Y!˔Q1~E4=~!wv'`$%}7[^._=8X,=SSE褥}tZJv$ś&%G봔pj)>AJ:րZ?	^G\$z(F?G-_*F[0kb>K:=<O_!|{@'8/hW钘clbt{!7DK:Џܴ sۅ)>6
SF֝spށ!9;GF</+TYL]0( </L*^*94UIGE-6-~Z-tGD!,]I1.BLݢQ/
FQDbtCcL톗^Rnѥi5ޅ96cyr@bz'e=Bx6ؕc1IT1J'`0,b6+l1<QM^|LX@*6hx-#憚JTړcUP5ǵǵJ>m(>p
?	+x T%jaT:Z)#*V!Vy|6NmXP\%=eG_*SPÃmM#mMٚ>:v8 XiraY4>o [?D|88B8>PhH6єqJk8bri+&|Ҥu6ۊP;?"EP};.8/{P{ξ5fg_ٱ*92g;Lafu9̰}4ξ
Y8{7ξξg_?gwlB	Hh擳xքv*
oCB	Hhw@;!$>y%z7T	^$IhƔv)*!2	ͧa(8sA1bqWOO"ƟBF1bab|א=HqkPǸa(12
bppkp??Bc5$lB	HhጄS	m߂oٿg~~ =G8cvg/ۙBg/k<{fpk?"C3Tl4PalK5FbXȥ6m3cvtxڍ0J(r֘;zgu:> S e1e1cǔ͔T SAL
1f*T̍1&%t15m6j7ҵjS@נcfpVШ$QEy4+Z2C ~<@>	6  AA&B BLA:m:XrID*{ү#H#ncs\;kڅ"k͑uTf,U
6V9Gkӣ	Ѿ,t-t-t-t-t-t-t-t-bal}#X:ndN[:ndN[:қafX2skԩ	ĜoJ!`˚c/e0@(k51>+5ax(`t"uSCSh*4I;A\^g<ivpϻ|Ü
tVZs<.9LՙqEiB:B6Ǳ8A|M0o[3?YDFDGDߪDߖM)i-b!aDەh׏W)?ߟ:0o2?VU
uj<w=IESx:Zo:g|KűJgAZl*+V#\V%g˪omVxyߦZd|7bh1}QGÏEU00xM@"'o@=]e8xQyNKs8]I^RQ*n*[|ʲ[/(lW|@\Y^+xv*N'1~J~M$şQ95ަw}~C@}z֍3
aFևTV(X>sAp^ vYf9/sI3ԟc>K?fD?[T-riBQLԔ|<%z,RbOشO;^q-Cn8Ƞ *@33%Y.+	։4S@<Q`-~ylX@ʶk_8X4`-tXnҢ7 -zҢ7 -zҢ7 -zҢ7 -z24X=3igMz挲wH+(Oy='Rg7 {\1){KҰZZ[tkƶ[LHR̴\f@3ÚsA͌;!)6XbZhA-6k-6k-6kG}gy6ILS>70hD$$y>'Z~,\nEl#']-63~5^,mNaok!,5>RxjfeG7KGO3̐ofC-!%ޮ@}~(ɶ:AXCGrX}#9\,#f>W-lه8unfe6GC,vz({2}>dU$'FIk`fX'в#|Y
y.MxX	cuW_){ </]ySuqɾS%7a	1uVzqLs
yR2J@Osм0$-L~Ђ#_>S.ʧi<J+~b-)+."#jOz.2:ӵ5]{隓]Jvеɮ恻wy.z\.}P:ԘZ: -\.aV׀5au59>m@.,_&YvE=t}hNYBͩ4ӜˤTO\;Zo?'=tV=a$ya{ޓU9t5feigfrs>yjǍ?JOYVB蚌|iB9,PF_W;XUkQ^*I.3A̰fFf?DXGUiA}FxBԳxwvva|l
5q|)l+r/,N\8M5ϡ憴P5jjZZCߡVPw;jgձ=L3zu`I* DqRLԉL1<ǴwtG9ȴ;)A9r'XSͼO2e^N6Jg^u9}Sjbc{mQy!d@ʶTTliz^VP]3'p\]*1.!l	R%
˸k&U0=Ki,-mhrvEт&NF5Ƚx0ZZbѩp<M "[ř<7Pļͽ4zs>gGUQ,`m
dU 5k(c鱏@?H/
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AZM=k/'xd$KvfZLPh_0Av6򏘠:+C@$D$}AU$0s54׺2\Xj.vr++>npe5wrv+yrN	P7< 7Ú'&y,C":+!9PBrM83pEj8K\srбZNaBs\,Bj9]H35M9

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&1OB S/R!,(9a`SP̽MEa36&6 cBul&JY}811N5<9ȕ<sTVvNΦͶ9\\x=f^ghJadsb?XO!G28Gb|\ZO/IChT$y=AMu&Ji@X%LdDm!L΃R[ZlҖmlזu
إ] wj}JxP[G5~UEhㄤ	I'$5NЧX:*5&b04fsjl6Scbs95GQPK
    ]n+  w     javax/vecmath/Point2d.class]OAitY@ZDd

ИKmBiݒ[?e<ti33<g??!ut!!9.\$<axe˒e+[rUNO0(ГqKf8T\v2]ܱ+._M;pCC̮'Ϝ$nɛ/XFbONB3Wd.chu/&lvRt`ojl!0}C=٥=B:zf 43tOC.e˵Jy7j'0Ѓ\Fq2i`CǔUK.kXgh{+~-'uChnhoɟzZh2ӼذV	umiSsv"tL%j55}Hu%H&YcO 7c -* ܢcGvyj%jQu:T1"g۱­zMVuKie#V65*Xc׺{bqW&u{5)XX爴G'=+ eª4Zߡ&ho/*y4+G)-JDyQ5tR%DiJj+%V:.FoCD%>*HH&Ep|+%vLc@;ľ@g+%z\Mg|ٿPK
    `n+R_J!Z       javax/vecmath/Point3d.classSrW=Wi$1A'@h,cA"S`YeGزuIQTvQGA%4)Jut}޼z(QIaSL&	sΧ)yOI,H.8㢎K:~Vϸu5G,Jc7FQ*uƲ\k.7lvjZkV8Reݶv{j7zk:vJ\w*%OFm*DxpɕDhĊ_yeOf&)DM9-n;TF6 R#%:
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d
0e~e2=gt"8BL#2r$(Yib{=B̓8K̑G"]8NWBiǥr-P/}St/\,LkNZ(W\r{RmA=*Se}GM{&<%Z:-}uJXzFhv&OaolQ>O>OH=??QM=!0
4(DpYQ\%H{=Sܶ8P-1CA8JJWqP6BP>LhF^X>+k_l-(3G]x7 G']fjRoƾr{PK
    `n+^sqb       javax/vecmath/Point3f.classS]oG=cov{!$%@6vMq[h |NCiJ^7K;啧H7>VDI~ ?2^Vsޙ;̽sͿF'CJ`VyQ$`^k($d\d᪅k+ߙ

ƕfS+*KuL~mE܍=vs~s668
9(8ZS-rcqVbk3 bruvȱZwf><;\wd;n-YXUJ4/})cPH"/lߨ)Xk҉עK4z|yJ[_D؍=GNLdmA|6n঍oqwBFMu]zݲ󛹒F}3Xs7km1qÙfR[4nHoPB|e
 93e^zeDf-hǰX摦C!X,RJW#Za;gf[_nTo#[\GqJ*GpMrer-H{ݫBj5^Z!W=+t#-RiqtM	KYUMy֠m:JH+6W*&)Fwa`/~q
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B|(F	m;(O,eC[bNt;8v6z1XN6>3s`*:C/N;=PK
    an+v       javax/vecmath/Point3i.classuN@iKXEEE7XEbЕBIbL nXlA2i\Μ2#PR@á"ZCɔL<yfP!Cq<أS&pVqIwt՚X,WyrЭk6e5c2Hm:Ȗ*ɽ`KFxԵEUGBBd+Ko|B+ܩ4mza.]/h롈}'@AEB{sO6I#gSN밅msQE]rbdoB<PqsHKٕOU|	$!XU,yU#V!ceuKP_PK
    `n+       javax/vecmath/Point4d.classT]S[U]7߹I-UjCb+#Gjk*::sI.pKH $Hq:W_:δ>׾9f\[଻{> 1\xCMxe%yw9N(T.	c"wM\UQE1"ܦۙ5T3d TnUw7TUKv_um'7{6ZZmv.Wקi pOfHT`ʌon}bwᨏ ^QӤ`_x<%mݬ9[]o^+pK`O-Q0*kim7ۭNBۮ9]9UKџQ1.0!䣸fI/I3bQ|`C,XX}<^}m^ݰ)xZVe*Ҫinػ2
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,vDb=bG*=BԓPrdH6wu-yJ(8CznWpcr}<^P\gqrrR\G WӇkYŕ{=vɵ+)>C{TV/HQ	9Ep"l."\Q萑c.,
-z>⃼0ۇN*;lg9{&)+MZLLbz:ґtKk_uG2w$W,)*0QbOAYbB+4^c/gs9"	ׇ+1֘!QE݇C<;A{^7TS-jբV-i&7$Q~'j֧=[<$Dxu8	$ıceG!yzg2oަZ>xPK
    `n+]       javax/vecmath/Point4f.classTmSU~6Y6aZ+jHL#_
րU(tt\l	R0ѷ~pF~s65&m	s<{/"7qs^xUa\E̽>L(PxDL\ƛ%#x++s4DEMh/+c%sNc^q&Qڊp&֚Ԑ,]Sް[k+uk"]O4Rڦ5</Qͩ?zeOr{iԝGs}%i}$OMWfVn8Ub`G4#-[q*~Qk.ۍStd@[81q@Z x\Y	}B)<;l*V,4軗;惚jxPn=jnO3|`6ܞdjS.aHCe9{&&}! 33qtR?R2'a,!ZN$NaX"ѦTW\,V
61FL ^_:QJ p\:MT?.!Wu W6D&L}`Sg>	
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dH2yZ:&-3IH+>8X&{#{8ֵ?S@tgDT1UUC^.ՂR-(q53Hݺݲ|^ߺgҞU߇`9i+{e;ıXqSqIxK>sr?PK
    cn+M:
       javax/vecmath/Quat4d.classXySL&/	
ZI2*أ2:n$0̠\ƥ.WpG(Zjbmkin}/wb&jι|﻿o{y/,r\;wv&Cp/_.m@@ny0£{ <eOiy,a/9>~I>M4ӤO>M4ӤO˓~ɐ9C3dΐ9C3dΐEaea
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xWDxys?7,%oZS%9db%VyJ<SkT'][]ӃT,s^/g`}_I}]FNY{5ц1c
mImRR/Rɦb
BA`E7tei@;Bѵh4X*a0@~J{{.xa()]}`RId;f5+t'L7xvt/1PҋbW;Yu,lbx[iqzyCyɸ٬(b:2?.Cq
QHtmLMS=/l\cI8V2D&l%l(_Y"M_p49
`a_IRǺ-{K{46kl!6f=ӬgZLiiYQ.Lź&x+'ӗ%rt;s	N▼K~n@v#\Op#apf5r%?....K޳}Kҧwӻ	N@>/$8kƵU.ȭ򑒉@ɤ=UHBauh&,8s`y}C*YX"ZSV,%zPi,?>Jkj2T`Mg(YT|Z+ᆐ]f[QD -2_xZ
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qsuky!9\s ʢ\\})bZ[k8\_)u˵jտE)˧$TGɥKLc;+x@[ҫbA( (^VT٥R+.-YYjeJYհkuZ-'\y̉j**k\?]uT'n c||ZAQEgW/sFg.Z׫Y5)Ö-Mup:4vH)DƏp	nF?SۨenQEgW/sFg.Z׫Y5)_cB؀kp}Uw^$TB{[J-)qqձP͎͎v;n;nQp(~!N]GD'/K:a=d֗էK7gf-Ev<,`jqVFTFTWqSqSb^uLuLu@@v@o";o!;+d:Wg.H:1ִ;w}iӬ7*إ͍̹D)F)J)4c`J X	iBlntC:y"X׆)cC¡BDCCCԬCY7xRrHNjF33O>ǖ_pp?Ň%Q8/ph#:d9?/T|Ljqڦ)KNP>iRyɺlmqcjZ-xPE&j	uI  +:'he  8  +            org/jmol/appletwrapper/ClassPreloader.classPK
    +:kOv  X  )            org/jmol/appletwrapper/TickerThread.classPK
    +:CFV     *            org/jmol/appletwrapper/WrappedApplet.classPK
    +:OW    0            org/jmol/appletwrapper/WrappedAppletLoader.classPK
    +:04  "               org/jmol/atomdata/AtomData.classPK
    +:      &            org/jmol/atomdata/AtomDataServer.classPK
    +:<!                org/jmol/bspt/Bspf.classPK
    +:kH                org/jmol/bspt/Bspt.classPK
    +:[  {               org/jmol/bspt/CubeIterator.classPK
    +:q   	              org/jmol/bspt/Element.classPK
    +:B8Ȑ  u              org/jmol/bspt/Leaf.classPK
    +:fQګ                org/jmol/bspt/Node.classPK
    +:@X                org/jmol/g3d/Awt3D.classPK
    +:	                | org/jmol/g3d/Circle3D.classPK
    +:jz  \              org/jmol/g3d/Colix3D.classPK
    +:fs.4  #             R org/jmol/g3d/Cylinder3D.classPK
    +:|               K org/jmol/g3d/Font3D.classPK
    +:	yvA               } org/jmol/g3d/Graphics3D.classPK
    +:Ʌ  $             O org/jmol/g3d/Hermite3D.classPK
    +:M               Y] org/jmol/g3d/Line3D.classPK
    +:HW-  d             ej org/jmol/g3d/Normix3D.classPK
    +:*&P    ,           q org/jmol/g3d/Platform3D$ClearingThread.classPK
    +:cF.               Et org/jmol/g3d/Platform3D.classPK
    +:}L               z org/jmol/g3d/Rgb16.classPK
    +:  
             0} org/jmol/g3d/Shade3D.classPK
    +:Ş9.  F              org/jmol/g3d/Sphere3D.classPK
    +:qz+                org/jmol/g3d/Swing3D.classPK
    +:kV
                org/jmol/g3d/Text3D.classPK
    +:\`4d  s              org/jmol/g3d/Triangle3D.classPK
    +:*  6  +            org/jmol/geodesic/EnvelopeCalculation.classPK
    +:                 org/jmol/geodesic/Geodesic.classPK
    +:}e  q              org/jmol/i18n/GT$Language.classPK
    +:u                org/jmol/i18n/GT.classPK
    +:T^  U  &           ! org/jmol/jvxl/api/MeshDataServer.classPK
    +:(7   (  (            org/jmol/jvxl/api/VertexDataServer.classPK
    +:"Q!  wb  &            org/jmol/jvxl/calc/MarchingCubes.classPK
    +:KC    6           t org/jmol/jvxl/calc/MarchingSquares$ContourVertex.classPK
    +:(t    5            org/jmol/jvxl/calc/MarchingSquares$PlanarSquare.classPK
    +:En  /  (           a org/jmol/jvxl/calc/MarchingSquares.classPK
    +:"w    !            org/jmol/jvxl/data/JvxlData.classPK
    +:u  0  !           q org/jmol/jvxl/data/MeshData.classPK
    +:ֳ    #             org/jmol/jvxl/data/VolumeData.classPK
    +:S    &           ) org/jmol/jvxl/readers/ApbsReader.classPK
    +:ͣ  c  *           6. org/jmol/jvxl/readers/AtomDataReader.classPK
    +:ޚb  h  &           3; org/jmol/jvxl/readers/CubeReader.classPK
    +:E/    (           > org/jmol/jvxl/readers/IsoFxyReader.classPK
    +:YT  H  '           3C org/jmol/jvxl/readers/IsoMOReader.classPK
    +:בyJ    (           J org/jmol/jvxl/readers/IsoMepReader.classPK
    +:0    *           \N org/jmol/jvxl/readers/IsoPlaneReader.classPK
    +:	`
    *           _Q org/jmol/jvxl/readers/IsoShapeReader.classPK
    +:0G  "  ,           \ org/jmol/jvxl/readers/IsoSolventReader.classPK
    +:  d  (           m org/jmol/jvxl/readers/JaguarReader.classPK
    +:J!  C  &           t org/jmol/jvxl/readers/JvxlReader.classPK
    +:g    -           X org/jmol/jvxl/readers/LimitedLineReader.classPK
    +:qB  h,  &           
 org/jmol/jvxl/readers/Parameters.classPK
    +:.<1}    .           # org/jmol/jvxl/readers/PltFormattedReader.classPK
    +:n  ;  ,           l org/jmol/jvxl/readers/SurfaceGenerator.classPK
    +:?f  /  ,           J org/jmol/jvxl/readers/VolumeDataReader.classPK
    +:q  V  ,           F org/jmol/jvxl/readers/VolumeFileReader.classPK
    +:Ɋst  1  '            org/jmol/jvxl/readers/VoxelReader.classPK
    +:9d  &  '           D  org/jmol/jvxl/readers/XplorReader.classPK
    +:/F                org/jmol/minimize/MinAtom.classPK
    +:P  Z             
 org/jmol/minimize/MinBond.classPK
    +:uQ    4           6 org/jmol/minimize/Minimizer$MinimizationThread.classPK
    +:	*  2  !            org/jmol/minimize/Minimizer.classPK
    +:  y             ' org/jmol/minimize/Util.classPK
    +:9K    .           0 org/jmol/minimize/forcefield/Calculation.classPK
    +:
  b  /           2 org/jmol/minimize/forcefield/Calculations.classPK
    +:ޜc  |  <           = org/jmol/minimize/forcefield/CalculationsUFF$AngleCalc.classPK
    +:r@  	  ?           F org/jmol/minimize/forcefield/CalculationsUFF$DistanceCalc.classPK
    +:ߣU  g  9           NK org/jmol/minimize/forcefield/CalculationsUFF$ESCalc.classPK
    +:>y#  L  :           O org/jmol/minimize/forcefield/CalculationsUFF$OOPCalc.classPK
    +:]y    ;           V org/jmol/minimize/forcefield/CalculationsUFF$PairCalc.classPK
    +:ot  j  >           =X org/jmol/minimize/forcefield/CalculationsUFF$TorsionCalc.classPK
    +:  	  :           8` org/jmol/minimize/forcefield/CalculationsUFF$VDWCalc.classPK
    +:ntS  #  2           e org/jmol/minimize/forcefield/CalculationsUFF.classPK
    +:`d&      *           t org/jmol/minimize/forcefield/FFParam.classPK
    +:` SM  "  -           u org/jmol/minimize/forcefield/ForceField.classPK
    +:7    0           D org/jmol/minimize/forcefield/ForceFieldUFF.classPK
    +:_.  0  $            org/jmol/minimize/forcefield/UFF.txtPK
    +:ļ4  B              org/jmol/modelset/Atom.classPK
    +:}.  `  &           ɹ org/jmol/modelset/AtomCollection.classPK
    +:̈R      )            org/jmol/modelset/AtomIndexIterator.classPK
    +:  z  /            org/jmol/modelset/AtomIteratorWithinModel.classPK
    +:`W    -           ( org/jmol/modelset/AtomIteratorWithinSet.classPK
    +:ʴSR    $           , org/jmol/modelset/Bond$BondSet.classPK
    +:6FC  #              org/jmol/modelset/Bond.classPK
    +:ygա  	%  &           = org/jmol/modelset/BondCollection.classPK
    +:>j      $           
 org/jmol/modelset/BondIterator.classPK
    +:(b    ,           
 org/jmol/modelset/BondIteratorSelected.classPK
    +:ڵE  
              org/jmol/modelset/BoxInfo.classPK
    +:oaj  
              org/jmol/modelset/Chain.classPK
    +:KWC$                org/jmol/modelset/Group.classPK
    +:JyE`    #           # org/jmol/modelset/Measurement.classPK
    +:un'}  7  *           1 org/jmol/modelset/MeasurementPending.classPK
    +:A	               4 org/jmol/modelset/Model.classPK
    +:v    3           > org/jmol/modelset/ModelCollection$StateScript.classPK
    +:XU    1           B org/jmol/modelset/ModelCollection$Structure.classPK
    +:!qδQ  r  '           D org/jmol/modelset/ModelCollection.classPK
    +:D7)  V  #            org/jmol/modelset/ModelLoader.classPK
    +:R  9               org/jmol/modelset/ModelSet.classPK
    +:\}_  	               org/jmol/modelset/Molecule.classPK
    +:\)                org/jmol/modelset/Polymer.classPK
    +:ѵu  
  '           I org/jmol/modelsetbio/AlphaMonomer.classPK
    +:7M    '           ; org/jmol/modelsetbio/AlphaPolymer.classPK
    +:^
$
    '           @ org/jmol/modelsetbio/AminoMonomer.classPK
    +:^7	    '            org/jmol/modelsetbio/AminoPolymer.classPK
    +:J;  96  %            org/jmol/modelsetbio/BioPolymer.classPK
    +:Ӭd  t  .            org/jmol/modelsetbio/CarbohydrateMonomer.classPK
    +:+2     .           8! org/jmol/modelsetbio/CarbohydratePolymer.classPK
    +:m_                8" org/jmol/modelsetbio/Helix.classPK
    +:Q*,	    "           $ org/jmol/modelsetbio/Monomer.classPK
    +:l  9  )           . org/jmol/modelsetbio/NucleicMonomer.classPK
    +:!d    )           7 org/jmol/modelsetbio/NucleicPolymer.classPK
    +:E    ,           ; org/jmol/modelsetbio/PhosphorusMonomer.classPK
    +:a      ,           $? org/jmol/modelsetbio/PhosphorusPolymer.classPK
    +:i    +           ? org/jmol/modelsetbio/ProteinStructure.classPK
    +:Vp7  #  #           +G org/jmol/modelsetbio/Resolver.classPK
    +:R#.                K org/jmol/modelsetbio/Sheet.classPK
    +:L                 oO org/jmol/modelsetbio/Turn.classPK
    +:W8    7           LP org/jmol/popup/JmolPopup$CheckboxMenuItemListener.classPK
    +:{k    /           ^R org/jmol/popup/JmolPopup$MenuItemListener.classPK
    +:T%  O             @U org/jmol/popup/JmolPopup.classPK
    +:>$8	  ]  !           h{ org/jmol/popup/JmolPopupAwt.classPK
    +:!d    #           ߄ org/jmol/popup/JmolPopupSwing.classPK
    +:DD>  K  (            org/jmol/popup/PopupResourceBundle.classPK
    +:"H  &  $           , org/jmol/quantum/MOCalculation.classPK
    +:lv  <  %           ; org/jmol/quantum/MepCalculation.classPK
    +:в  /	  )           3 org/jmol/quantum/QuantumCalculation.classPK
    +:ۿP                org/jmol/shape/AtomShape.classPK
    +:o_Vg>               " org/jmol/shape/Axes.classPK
    +:QIV  =  !            org/jmol/shape/AxesRenderer.classPK
    +:@Nt                org/jmol/shape/Balls.classPK
    +:&~  	  "           l org/jmol/shape/BallsRenderer.classPK
    +:$xQ               * org/jmol/shape/Bbcage.classPK
    +:\1x  T  #            org/jmol/shape/BbcageRenderer.classPK
    +:W               m org/jmol/shape/Dots.classPK
    +:c    !           L" org/jmol/shape/DotsRenderer.classPK
    +:r   {             ) org/jmol/shape/Echo.classPK
    +:G\    !           1 org/jmol/shape/EchoRenderer.classPK
    +:;QG  '  "           7 org/jmol/shape/FontLineShape.classPK
    +:`    *           9 org/jmol/shape/FontLineShapeRenderer.classPK
    +:k  {             x< org/jmol/shape/Frank.classPK
    +:c
    "           C@ org/jmol/shape/FrankRenderer.classPK
    +:z.  h             ^C org/jmol/shape/Halos.classPK
    +:|    "           AG org/jmol/shape/HalosRenderer.classPK
    +:eg  W             L org/jmol/shape/Hover.classPK
    +:l6    "           UR org/jmol/shape/HoverRenderer.classPK
    +:*  R%             ?V org/jmol/shape/Labels.classPK
    +:q    #           Oh org/jmol/shape/LabelsRenderer.classPK
    +:v  ,             p org/jmol/shape/Measures.classPK
    +:U<  !  %            org/jmol/shape/MeasuresRenderer.classPK
    +:-Z
                org/jmol/shape/Mesh.classPK
    +:]b  l#  #           l org/jmol/shape/MeshCollection.classPK
    +:N	  
  !            org/jmol/shape/MeshRenderer.classPK
    +:ONG|               , org/jmol/shape/Object2d.classPK
    +:B  R  "            org/jmol/shape/Object2dShape.classPK
    +:                org/jmol/shape/Shape.classPK
    +:a    "            org/jmol/shape/ShapeRenderer.classPK
    +:.Xr                 | org/jmol/shape/Stars.classPK
    +:,  [  "           & org/jmol/shape/StarsRenderer.classPK
    +:               x org/jmol/shape/Sticks.classPK
    +::A5    #            org/jmol/shape/SticksRenderer.classPK
    +::gai  S              & org/jmol/shape/Text.classPK
    +:tR  K             	 org/jmol/shape/TextShape.classPK
    +:L8]               		 org/jmol/shape/Uccage.classPK
    +:/  U  #           {	 org/jmol/shape/UccageRenderer.classPK
    +:  Q              	 org/jmol/shapebio/Backbone.classPK
    +:Ѱf{    (           	 org/jmol/shapebio/BackboneRenderer.classPK
    +:CV-
  #              r	 org/jmol/shapebio/BioShape.classPK
    +:xy    *           S&	 org/jmol/shapebio/BioShapeCollection.classPK
    +:yu  0  (           .	 org/jmol/shapebio/BioShapeRenderer.classPK
    +:c                E	 org/jmol/shapebio/Cartoon.classPK
    +:j    '           F	 org/jmol/shapebio/CartoonRenderer.classPK
    +:>bd     "           O	 org/jmol/shapebio/MeshRibbon.classPK
    +:R  N  *           P	 org/jmol/shapebio/MeshRibbonRenderer.classPK
    +:jɀ                 S	 org/jmol/shapebio/Ribbons.classPK
    +:+#?4+    '           cT	 org/jmol/shapebio/RibbonsRenderer.classPK
    +:ef                U	 org/jmol/shapebio/Rockets.classPK
    +:\K  q  '           V	 org/jmol/shapebio/RocketsRenderer.classPK
    +:p                 b	 org/jmol/shapebio/Strands.classPK
    +:#  <  '           c	 org/jmol/shapebio/StrandsRenderer.classPK
    +:6y  i             f	 org/jmol/shapebio/Trace.classPK
    +:XS    %           h	 org/jmol/shapebio/TraceRenderer.classPK
    +:3    "           i	 org/jmol/shapespecial/Dipole.classPK
    +:~C  ?*  #           q	 org/jmol/shapespecial/Dipoles.classPK
    +:0    +           U	 org/jmol/shapespecial/DipolesRenderer.classPK
    +:!5"&  K              p	 org/jmol/shapespecial/Draw.classPK
    +:;o    $           @	 org/jmol/shapespecial/DrawMesh.classPK
    +:(>  C  (           j	 org/jmol/shapespecial/DrawRenderer.classPK
    +:٥mh    0           A	 org/jmol/shapespecial/Ellipsoids$Ellipsoid.classPK
    +:P    &           J	 org/jmol/shapespecial/Ellipsoids.classPK
    +:#  d'  .           	 org/jmol/shapespecial/EllipsoidsRenderer.classPK
    +:Jp   (  &           	 org/jmol/shapespecial/GeoSurface.classPK
    +:@    .           	 org/jmol/shapespecial/GeoSurfaceRenderer.classPK
    +:t?    0           	 org/jmol/shapespecial/Polyhedra$Polyhedron.classPK
    +:WXZ  ?%  %           	 org/jmol/shapespecial/Polyhedra.classPK
    +:^    -           
 org/jmol/shapespecial/PolyhedraRenderer.classPK
    +:N  Q  #       <U[DO#~mE܉hkRbDk('3-#jP2˘ms,HNgbZ-b=G<?˿5HhUEQkYF("Xl,@`ο<-cMmagk[--x})1!Uj3,={ls=<skl@t&?Ij}F.	ߣBmi[y%9@DN8WhWZ^ Tei(] HڐCrF{_`i	ZinmXd$dҒXA7nf햶nrC<⚋j+->25kѢE$h]!ZWm'.B8`ö[(?k8kXd%pz,w#AAb9uWkn6Q<diiCue1|! ٘ m+/"[XKnWt	'y}T^PMnp	ە(۷M|jO8_7S\=¦̎Pt,pNL쭴{]tTd3Z9G(<ô?TAT3Q<q,̿VWGW7$oTj19s6}vUnꎴb\gnyD5-B
rG~"'ucFvUMLXf}el%GGvoNX"j_F:t(Hu4еQъk5i7q<cvk=&pq:.(ϰ|''V3w}75ύ.q	k)Jq3sL-4q;TОܟnBY\TTK:ct};䧥oWSyCmه;Kh3i_Fk)@!S-]$XIصCmbF!EEvq5Ӽv}
.IuL7qTsm\WqMqW*݃ZuNAwȀ}e!ձYb{ӟѽ2	~884-ѹB)KO7z	L"=Fq(MqgS{qevPJ]ߟHO\Ǵt$:G"bȩkǙd*BOWFyӼ'%DGKQ
mm"ç} 5޶q#V`ɬeGSb_z+(^^KB_sJSո&`yDӶo;~}-.U OEHhٕJH;шbEl^V}眥xZ{{{uIȤ\3Y]`uP3=MK%vÖBbKzҎJ'w:OGѨ@vEm7Pyy7|R"\fNDɍ;hK5'=|=&{Hu:kYUe'%ݶ8%׹xv/z;ٝG	
zo1Ԕ|ZO5J<qk[ijGrOU,X;ckx@gUI)??-A??#"?GU~\CjaU"L'T8BOUʿ/*<_RUWT$?%Eh7qo<|]N"c8b<ÍȟSSWjbE5E^D8h{?qJ?/\KWUvCߺ꿣]?PgW5U+_wF?]7/WT&ruqW]̏/je\Ûs fZ?ǎ3=
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D𶇽%"Yar1c	~lcZNP6|fE$Y9˗"d)OTq!XT{8kPچMH:MRrz<`<pSEpuV]fbA_mSWPKq   	  PK   +:               org/jmol/bspt/Leaf.classuRMoQ=N)cfB$iH.˴)C/2+k46}@0/ޙ{9ן?  L*En
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!xn0Usfq5A)޿@-o絠q^tTÿY"Qgquo4_1%'w3쁭\m_11J S1|0+UvO.t6&#=QvtObGkyD:لϵ!9_ PKfQګ    PK   +:            #   org/jmol/export/AxesGenerator.class;o>f].. fYb✟ _ZQ_TXZ잚ZX_ /H,HK楤1(20F $ـ<A0Uk;F PKt2      PK   +:            '   org/jmol/export/BackboneGenerator.class;o>f].. fYb✟Ƞ_ZQ_TꞚZX_ȠWSXWZZĠh4d|V
 PK      PK   +:            $   org/jmol/export/BallsGenerator.classN@ϥ@[PYP%D1WodĚ!CVDw&=G`Xbk֑ӱMyl1	wSְzdG9Asyxظr`?gy`bضz&22CD	e0TMpH( |22C\:0~pF<o!ֹ|Lgc.;&ԖƀѨ!ްc7xMuN5w	eY1o]**$@a STO5_AO!	\Q_$zzAr؍/PKB  I  PK   +:            %   org/jmol/export/BbcageGenerator.class;o>f].. fYb✟ _ZQ_TꞚZX_ WQX
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 PK36      PK   +:            &   org/jmol/export/CartoonGenerator.class;o>f].. fYb✟Ƞ_ZQ_TXT瞚ZX_ȠWRXSZZĠh0d|V
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 PK1rB      PK   +:            #   org/jmol/export/DotsGenerator.class;o>f].. fYb✟ _ZQ_T_R잚ZX_ /H,HK楤1(20F $ـ<A0Uk;F PK/%Ń      PK   +:            #   org/jmol/export/DrawGenerator.classU
`OzYT(+8ZoA_AS/rHΗ+LPB>\E% vgFj7d!k?QZyg"AEUBC長٩ǇHi3ڏ8x'5pɚC4_?ia!#ّ*Jt|,ro&!jwPKv     PK   +:            #   org/jmol/export/EchoGenerator.class;o>f].. fYb✟ _ZQ_TZX_ /H,HK楤1(20F $ـ<A0Uk;F PKg`d      PK   +:            )   org/jmol/export/EllipsoidsGenerator.class;o>f].. fYb✟Ƞ_ZQ_TYPR잚ZX_ȠWUXZ\6(5/%(A	h30!
 	Z70  PKl6      PK   +:               org/jmol/export/Export3D.class	TXq,XH;`(c&G,b8aqm6I\&mݦi4FI;v}_JyNgϟ?<wAԱ耟9xO;a~A~E	[Np?_hWf?h|>C:>> pɀ1ıi,l($dav:8Q'L.NVȊPL`:8%>sջiVN8/}V(\Ep	TCԹ4;<OG	#'PC}f, PO	K"Hx EzHxOMɆFx,:A1phJ%elP$֧F#})d,]'RjAUFCx0Z'918pSo	ooSé5@W7qaBH34!C~DM-70X=*jqt Z&}$!m4B%GZuGMY}A>DPg*)ܽ5FcPwBUԞh;6dWE
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# POV-Ray cleaner for Molecular Orbitals
# bug fix: getproperty atominfo returning string to Integer()
# PDB remediated atom name upgrade -- NEEDS CAREFUL CHECKING

# -----------------------------------------------------------------------------

#version=11.3.34

# write povray [width] [height] filename

# POV-Ray for mapped isosurfaces
# POV-Ray embeds Jmol script
# POV-Ray .pov files created by Jmol can be loaded as scripts


# code: cleaning of JmolConstants specialAtomNames
# code: cleaning of TextFormat.simpleReplace
# bug fix: select [SET] or [2MO] or [DB']
# bug fix: app -c flag errors not going to Logger.Error
# bug fix: no partial charges!
# bug fix: 11.3.14+ does not write colormapped JVXL files
# bug fix: Using isosurface within 1.0 @pt1 where pt1 is a draw point save state cannot be restored  

# -----------------------------------------------------------------------------

#version=11.3.33

# code: PovRay tweaks -- multiple bonds
# code: PovRay output uses BufferedWriter

# adds support for "xx'" atom designations in PDB and variable names

# bug fix: insertion codes stored incorrectly in 11.3.32

# new feature: inline scripting allows math
#
#   script INLINE "select " + site_list[2]


# new feature: site_ support for PDB and CIF
#
# loading of PDB and CIF files containing site information 
# automatically defines variables site_xxx and defines selections site_xxx and site_n
# where xxx is the site identifier and n is the site number.
# These settings are reset each time a file is loaded. 
# They do not carry over from one file to the next.

# adds    "OP1" and "OP2" as backbone designators (new PDB designation)


# _PovrayExporter adds draw, halos, stars, dipoles, vectors, polyhedra, 
#    backbone, cartoons, meshRibbon, ribbon, rockets, strands, trace,
#    dots, geosurface, molecular orbitals, LCAO cartoons, pmesh, 
#    single-color isosurfaces

# Web Export Dialog changes: new intro tab, new minilog at bottom, instructions converted to
#   buttons which open the info in the standard Jmol Help Dialog.


# bug fix: rockets color incorrect for head groups

# -----------------------------------------------------------------------------

#version=11.3.32

# bug fix: vibration disabled in 11.3.31
# bug fix: zoomto cancels slabbing
# bug fix: zoomto (atomExpression) 0  # zooms to 2x

# new feature: getproperty stateinfo TYPE
# where TYPE is one of:
#
#   colorState
#   dataState
#   fileState
#   frameState
#   modelState
#   perspectiveState
#   selectionState
#   variableState
#   windowState
#   
# bug fix: backbone not in state

# code(I): Mmset merged into ModelSet; 
#       Viewer accesses ModelSet methods directly
#       ModelManager streamlined substantially
#
#   This basically removes two full layers of abstraction.
#   All the atoms, bonds, and models are now in ModelSet.
#
# code(II): ModelSet extends ModelCollection extends BondCollection extends AtomCollection
#
# bug fix: dipoles moved back into shape from shapespecial
# bug fix: semi missing in show orientation message, second part (zyz text)
# bug fix: select 0 selects all instead of PDB group 0
# bug fix: write t.xxx

# -----------------------------------------------------------------------------

#version=11.3.31

# bug fix: calculate aromatic for N and O refined

# new feature: valence -- sum of bond orders
#  print {atomno=3}.valence
#  {atomno=1}.valence = 3  
#  select (carbon and valence != 4)

# new feature: settable atom properties (preliminary):
#  .x, .y. .z, .xyz, 
#  .fx, .fy, .fz, .fxyz,
#  .vx, .vy, .vz, .vxyz,
#  .formalcharge, .occupancy, .partialcharge
#  .temperature, .valence 
# for example:
#   a = {atomno=30}
#   a.xyz = {1.0, 2.0, 2.3}
#   a.temperature = 3.0
#   a.formalcharge = 2

# new feature: set atom properties using {xxxx}.x = 
#
# {atomno=3}.x = 3
# {(*)[2]}.xyz = {1 2 3}
# for(var i = 1; i < 3; i = i + 1); {(*)[i]}.x = 5;end for;
# {atomno=3}.property_whatever = 2.0

# new feature: set atom properties using an array instead of a DATA statement:

# {*}.property_mydata = array(1.0,5.5,4.4,3.3);
# {*}.property_mydata = "3 4 5 6 7 8";
# {atomno < 4}.xyz = array({3 4 5},{4 5 6},{5 6 7})

# code optimization for within() and setAtomBits()

# more export generator classes

# bug fix: unitcell missing some lines when axes turned off

# -----------------------------------------------------------------------------

#version=11.3.30

# new feature: adds H/Br/Cl/I/C logic to aromatic bond assignments
# new feature: adds Oxygen/Sulfur logic to aromatic bond assignments
# new feature: adds Nitrogen logic to aromatic bond assignments
# bug fix: menu for UNITCELL 

# new feature: PovrayExporter (pim schravendijk <pimlists@googlemail.com>)

# -----------------------------------------------------------------------------

#version=11.3.29

# new feature: aromaticSingle and aromaticDouble bond order options
# new feature: "smartaromatic" bonds # turned off with "smartAromatic = false"
# new feature: calculate aromatic    # calculates reasonable aromatic double/single alternation.   
# new feature: reset aromatic        # sets all aromaticDouble and aromaticSingle back to aromatic
# new feature: select ISAROMATIC     # selects aromatic atoms
# new feature: MOL reader recognizes bond types 4,5,6,7

# new feature: isosurface/mo "squared"

# new feature: fully generalized bond order "partial n.m"
#   n = number of lines, up to 5
#   m = binary mask for dottedness, up to 31 (0x1F)
#         00001  first line of bond dotted
#         00010  second line of bond dotted
#         00011  first and second line of bond dotted, etc.    

# new feature: connect may use numeric bond orders, including "partial n.m"

# new feature: preliminary work on functionalized state
# new feature: global/local functions (to applet, for instance
#   in general, functions are global -- common to all applets.
#   first-character "_" indicates this function is a LOCAL function, private to this applet.

# -----------------------------------------------------------------------------

#version=11.3.28

# critical bug fix for color command not coloring objects properly
# new feature: bondOrders 2.5 and -2.5  PartialTriple and partialTriple2

# -----------------------------------------------------------------------------

#version=11.3.27

# critical bug fix for functions not returning values
# bug fix for atomarray[i] not selecting properly
# bug fix for write not working with VAR
# bug fix for application not accepting pastes into the
#   console consisting of multiple lines
# bug fix for bondOrder command not properly treating 4.0 or 0.5
# bug fix for decimals not represented properly in error messages 

# -----------------------------------------------------------------------------

#version=11.3.26

# new feature: _1 parameter for "first atom" in second expression of connect:
#   connect 3.0 (_H and connected(_N) (_O and not within(chain,_1)) hbond 
# new feature: better reporting of PMESH file format errors 

# code cleanup: pmesh moved to shapespecial; privatized

# bug fix within(chain,xxx) not working
# bug fix for() as first command in script or line
# bug fix we were not exporting error free xhtml 1.1.
# bug fix for WebPageMaker not writing files
# bug fix for PAUSE causes app to hang -- this is a reversion of use of SwingUtilities.invokeLater(),
#  which actually will not work in ScriptWindow. We need the direct execution in
#  order to avoid the event queue from stopping itself.

# -----------------------------------------------------------------------------

#version=11.3.25

# bug fix compiler not recognizing "axes =" or "measures = "
# bug fix for WebPageMaker creating uncompressed PNG
# bug fix for WebPageMaker not stripping \ in load file names

# -----------------------------------------------------------------------------

#version=11.3.24

# critical bug fix for 11.3.23 compiler not recognizing line endings
# bug fix for show state for draw in multi-model environment
# bug fix? for background model not available for multiple frame range (e.g. frame 2.0) or after invalid frame number
#
# new feature: within(distance,isWithinAllModels,atomExpression)
#
# allows finding atoms within a specified distance of other atoms in OTHER models:
#
#   select within(5.0,true,model=2.1)  # TRUE indicates we should check all models
#   select within(5.0,false,model=2.1) # FALSE -- only model 2.1
#   select within(5.0,model=2.1)      # default is FALSE

# -----------------------------------------------------------------------------

#version=11.3.23

# VERSION full script flow control support:

# if / else if / else / end if
# for / end for
# while / end while
# 
# var i = 4
# if (i = 3)
#   print "i=3"
# else if (i = 4)
#   print "i=4"
# else if (i = 5)
#   print "i=5"
# end if
#
# var i = 5
# while ( i > 0)
# 	print "atom " + i + " " + {atomno=i}.ident + " is at " + {atomno=i}.xyz
# 	i = i - 1
# end while
#
# n = {*}.size
# for (i = 1;    i <= n; i = i + 1)
# for (j = i + 1;j <= n; j = j + 1)
# 
# 	var dist = {atomno=i}.distance({atomno=j})
# 
# 	if (dist < 1.77)
# 		 print "i-j: " + i + "," + j + " " + dist%2
# 		 measure {atomno=i} {atomno=j}
# 	endif
# 
# end for
# end for
#
# var i = 4
# while ( i > 0)
# 	print "in while: i="+i
#	if (i = 2);print "i is 2";endif
#	i = i - 1
# end while
#
#

# -----------------------------------------------------------------------------

#version=11.3.22

# Changes to webexport package only
#	New Features: textboxes for entry of author name and title for browser window
#		persistence across launches of authorname and applet size
#		automatic gzip of large structure/quantum files.
#	Bug? fix: update the page templates to XHTML 1.1
#	Minor fixes to instruction .html files.

# tweak: using "var" keyword prevents display of global variable value 

# -----------------------------------------------------------------------------

#version=11.3.21

#
# bug fix: isosurface of MOs not properly displaying color in saved state
# bug fix: state saving of @ definitions has extra = sign.
#
# new feature: fully functional user-defined functions:
#
# MACROS (no parameters)
#
# function mymacro
# 	background red
# 	color atoms blue
# end function
# 
# function mymacro2
# 	background black
# 	color atoms cpk
# end function
# 
# background white
# delay 2
# 
# mymacro
# 
# delay 2
# 
# mymacro2
# 
#
# SUBROUTINES (parameters, but no return)
#
# function drawline(id,a,b)
#   var x = script("draw line"+ id + " {atomno=" + a + "} {atomno=" + b + "}")
# end function
#
# drawline(1,3,5)
# drawline(2,10,12)
#
#
# FUNCTIONS (parameters and returns)
#
# function d(a,b)
#	return a.distance(b)
# end function
# 
# x = d({atomno=3},{atomno=4})
# print x
#
# SHOW AND WRITE:
#
# show functions
# 
# write functions macros.spt
#

# -----------------------------------------------------------------------------

#version=11.3.20

# bug fix for arrows way too fat (introduced in 11.3.19) :(

# -----------------------------------------------------------------------------

#version=11.3.19

# bug fix: critical arrow fix of 11.3.17 for 2-point arrows
# bug fix: write PNG default was 0 compression. -q flag was OK for setting 0-9
# bug fix: ragged arrow tip 

# -----------------------------------------------------------------------------

#version=11.3.18

# critical bug fix for 11.3.17 in regard to serialization of arrays
# also introduces
#
#  reset ALL  # resets all user-created variables
#
# also "exitJmol" typed into the script window for the application does that.
#

# -----------------------------------------------------------------------------

#version=11.3.17

# bug fix: problem with unescaping comma-separated point strings "{1,2,3}" as a point.
# bug fix: drawn arrows scale improperly when zooming; arrow heads off-kilter

# new feature: set defaultDrawArrowScale # 0.5 initially
# Drawn arrows now have a head size that can be set and a dimension that
# scales with the model, so arrow head:atom size ratio remains constant
  
#
# new feature: setting Jmol,Rasmol,Shapely,Amino,Roygb,Rwb
# color schemes makes those colors the default colors for these schemes. 

# rename byResidue_jmol --> byResidue_shapely
# rename byResidue_rasmol --> byResidue_amino

# new feature: array variables saved as arrays
# prior to 11.3.17, you could not do:
# 
# x = "this is a test".split(" ")
# y = x[3]
#
# because x was only saved as a string, not an array
# now x is saved as an array, so this is no problem.
#
# new feature Jmol math point(x,y,z) function
#
# point(a,b,c) or point("{x,y,z}")
#
# x = point(y[3], y[6], y[2])
# x = point("{2,3,5}")
#
# needed because, with simple numbers, just
#
# x = {3.0,4.0,5.0} 
#
# works, but 
#
#  x = {r,g,b}
#
# does(did) not.
#
# new feature: Jmol math array element assignment:
#
# a = "2,3,4,5".split(",")
#
# a[3] = "now the 4 becomes this phrase"
# a[a[2]] = "not any more; now it's this"
# a[0] = "setting the final element"
# a[6] = "expanding the array"
# print a
#
# 2
# 3
# not any more; now it's this
# setting the final element
# 
# expanding the array
#
# works with strings as well:
#
# a = "this is a test"
# a[8] = " not"  
# print a
# >> a = "this is not a test"
#
# new feature: Jmol math x = array(a,b,,,,)
#
# x = array(3,4,5,6)
# print x[3]
# >> 5
#

# new feature: Jmol math plane(x,y,z,w) function
#
# plane(a,b,c,d) or plane("{x,y,z,w}")
# or through three points:
# plane({atomExprOrPoint},{atomExprOrPoint},{atomExprOrPoint})
# or through three points with a reference point
# plane({atomExprOrPoint},{atomExprOrPoint},{atomExprOrPoint},{atomExprOrPoint})
#
# x = plane(y[3], y[6], y[2], 3.0)
# x = plane("{2,3,5,4}")
# x = plane({_H}[1],{_H}[2],{_H}[3],{_C}[1])
# new feature: print command prints a variable expression
#
# print x
# print x * 3
# print x[4] + x[3]
# print x.split(" ")[2][0]

# new feature: aPlane.distance({some atoms})

# new feature: someArray.add("string") adds string to right of each item
# new feature: someArray.sub("string") adds string to left of each item

# colorManager clean-up

# -----------------------------------------------------------------------------

#version=11.3.16

# bug fix: Eval RPN processor for list[n] addition operator not doing selection
 
# new feature: MOPAC mgf file UHF orbital reading -- preliminary only

# new feature: byElement and byResidue color schemes allow 
# customized element and residue coloring schemes. 
# built-in include: byElement_Jmol, byElement_Rasmol,
# byResidue_Jmol (shapely) and byResidue_Rasmol (amino) 
# with abbreviations byElement == byElementJmol; byResidue == byResidue_Jmol
# color atoms "byresidue_Jmol"
# 
# Users can set up their own byElement and byResidue color schemes
# simply by preficing a name with "byElement" or "byResidue":
#
# color "byElement_Mine=[x......] [x......] [x......] ..."
#                       0(unknown)    1(H)    2(He) ...
#
# then:
#
# color atoms "byElement_Mine"
#
# RANGE min and max are ignored for byElement and byResidue schemes,
# and there is no scaling done ever, so effectively these prefixes
# make the correlated value a simple index into the array.
# This is what one would want for something that should be a given 
# for a specific element or residue
# 
# Residue indexes in order correspond to the groupID of an atom:
#
#    0  noGroup, 
#    1  ALA, ARG, ASN, ASP, CYS,
#    6  GLN, GLU, GLY, HIS, ILE,
#   11  LEU, LYS, MET, PHE, PRO,
#   16  SER, THR, TRP, TYR, VAL,
#   21  ASX, GLX, UNK,
#   24  A, +A, G, +G, I, +I,
#   30  C, +C, T, +T, U, +U
#
# so this opens the door to user-created residue coloring schemes.
#
# color "byResidue_Mine=[x......] [x......]..."
#                       nogroup   ALA    ...
#
# then 
#
# color cartoons "byResidue_Mine"

# -----------------------------------------------------------------------------

#version=11.3.15

#s, JmolPopupMenu.jar,
# JmolNavigation.jar, JmolBio.jar, Jm  olSurface.jar, JmolXtal.jar, etc. 
#
# Then a developer can slim down the download. The minimum is 697K, 
# about 58% of the full package. All that gets you is atoms, bonds, 
# and measures. 

# -----------------------------------------------------------------------------

#version=11.1.16:

# First incompatibility found:
#
# set echo myecho (atomno=3) or (atomno=5)
# 1) adds two new modifiers:
#  .min
#  .max
#
# as in:
#
#  x = {*}.bonds.length.max  #the longest bond length
#  x = {*}.atoms.max         #the last atom
#
# 2) extends find() to sets of lines. For example:
#
#  longLine={*}.bonds.label("%=, %LENGTH").lines.find({*}.bonds.length.max)
#  message @longLine
#  longest = longLine%(longLine.find(",")-1)
#  b = {*}.bonds[longest]
#  select b_set;color bonds yellow
#
# NOTE: _set removed in 11.3.41:
#  select @b;color bonds yellow
#  
# -----------------------------------------------------------------------------

#version=11.1.15:

# APPLICATION: adds undo/redo to a fixed depth of 50 commands
#
# TYPE CONVERSION
#
# We have eight different variable types now:
#    boolean    True/False 
#    integer    0, 1, 2, ....
#    decimal    3.5, 3.25E-3
#    string     "test" "3.5"
#    point      {2.3 3.4 5.6} {0 1/2 1}
#    plane      {0 1 1 0}
#    atomset    {oxygen}
#    bondset    {oxygen}.bonds

# plane and bondset are new; arithmetic operations are not fully developed.

# These can be mixed and matched to good effect. Certain relatively
# intuitive rules apply. Usually the operand on the left sets
# the overall type, allowing for easy type conversion depending upon 
# operand order:
#   int + float:
#     0 + 3.6 ==> 3    (int on left rounds float on right)
#     3.6 + 0 ==> 3.6  (float on left sets result)
#
#   int/float + string:
#     0.0 + "3.5" ==> 3.5 (string converted to float)
#     0 + "3.5"   ==> 3 (string converted to float, then int)
#     "3.5" + 0   ==> "3.50" (integer converted to string)
#     "3.5" + 0.0 ==> "3.50.0" (float converted to string)
#
#     1.0 + {carbon}.xyz     ==> 1 + distance from {0 0 0} to {carbon} center
#     {carbon}.xyz + 1       ==> {carbon} center point offset by {1 1 1}
#
#     x = {carbon}.xyz * {1 0 0} ==> (dot product)
#
#     Now x is the average x coordinate of carbon
#
#  Boolean expressions are a bit different in that the operators 
#  AND, OR, XOR, and NOT all require conversion to boolean UNLESS both
#  operands are atom expressions, in which case these operate directly on the
#  atom sets and return a new atom set, just like in SELECT.
#
#     3 and 0.5  ==> TRUE (both are nonzero)
#     false OR 2.0 ==> true (2.0 is not 0, so it is TRUE)
#     {oxygen} and {molecule=1} ==> all oxygen atoms in the first molecule
#
#     x = ({oxygen} and {molecule=1}).xyz 
#
#     x is now the center point of all oxygen atoms in the first molecule
#
#  In standard math, boolean TRUE evaluates to 1.0; FALSE evaluates to 0.0
#
#     true + 2.0 ==> 3.0 ("TRUE" evaluates to 1.0 in math operations)     
#     2 + true ==> 3 ("TRUE" evaluates to 1.0 and is then turned into an integer)     
#
#
# ATOM EXPRESSION AUTOMATIC DEFINE
#
# When you set a variable to a value, and that value is a point, plane, or atom expression,
# then Jmol automatically registers the result as follows:
#
#  points:
#    x = "{x y z}"
#
#  planes:
#    x = "{x y z w}"
#
#  atom expressions:
#    x = n
#    x_set = "({i j k ...})"
#
# NOTE: "set x" removed in 11.3.40:
# NOTE: _set removed in 11.3.41:
#
#    x = {oxygen}.xyz
#    y = {carbon}.xyz
#    draw @x
#    draw @y
#    draw line1 @x @y
#
#   and
#
#    x = {carbon}[3][5]
#    select @x
#    color green

#    x = {carbon}[3][5]
#    select @x
#    color green

#
#    x = {carbon or oxygen}.bonds
#    select BONDS @x
#    color bonds green

#
# DATA() function and variable option for DATA command
#
# x = data({atomno < 10},"xyz")
# x = data({atomno < 10},"mol")
# x = data({atomno < 10},"pdb")
#
# data "model @x"
#
# write data t.xyz
# write data t.mol
# write data t.pdb
#
#
# Better BITSET implementation 
#
# CHANGE: default string value for a bitset is now the ({n:m})
# string format, which can be used in numerous commands.
#
# To get the count within a string context, just use .size:
#
# x = "number selected is " + {selected}.size
#
# or force integer math:
#
# x = "number selected is " + (0 + {selected})
#
# merges math functions within(), connected(), substructure() into molecular math
#
# adds connected() both for finding atoms and for identifying bonds:
#  xAtoms = connected(3, {carbon})
#  xBonds = connected(1.3,2.5,"single", {carbon} {oxygen})
#
# adds
#  x.atoms
#  to go along with x.bonds   
#
# adds distance({carbon},{oxygen})
# adds angle({carbon}[4],{oxygen}[3], {nitrogen}[2])
#
# angle function accepts from three or four 
# atom expressions or XYZ coordinates and returns a decimal number for
# the distance, angle, or dihedral relating these points. 
# When more than one atom is involved, average positions are used. 
#
# Note that when more than one atom is involved in a set, 
# the following are different:
#
#  x1 = {molecule=1}.distance{molecule=2}
#  x2 = {molecule=1}.xyz - {molecule=2}.xyz
#
#  x1 is a NUMBER that is the "average distance measured 
#     from each molecule 1 atom to the average molecule 2 position"
#  x2 is a point representing the VECTOR from the "average position of molecule 2" 
#     to the "average position of molecule 1"
#
# The following are all equivalent:
#
#  x3 = {molecule=1}.xyz.distance{molecule=2}
#  x4 = 0.0 + ({molecule=1}.xyz - {molecule=2}.xyz)   
#  x5 = ({molecule=1}.xyz - {molecule=2}.xyz).distance{0 0 0}
#  x6 = distance({molecule=1} {molecule=2})
#
#  They are all the distance from the center of molecule 1
#  to the center of molecule 2
#
#
# x = load("filename")
#
# The string data in the file are loaded into the string.
# If the file does not exist, then the string contains the error message.
#
#
# Implements ({i j:k m n}) bitset option across all commands
#
# RESET varName
#
# reset varName  # clears that variable definition
#
#
# "UNSPECIFIED" and "QUADRUPLE" BOND TYPES
#
# An additional bond type is now avaiable: "UNSPECIFIED". 
# This shows up in the MOL2 reader and may be selected for and modified using, for example:
#
#  select connected(unspecified)
#  color bonds red
#
# or
#
#  select connected(unspecified)
#  connect (selected) single modify
#
# In addition, we now can depict quadruple bonds.

# -----------------------------------------------------------------------------

#version=11.1.14:

# DYNAMIC MEASUREMENTS
#
# Now that we can move atoms so easily, we don't want those measurements getting stale.
#
# set dynamicMeasurements
#
# allows measurements to be recalculated on the fly.
#
#
# MEASUREMENT FORMAT STRINGS
#
# Measurement format strings can be set using
#
# measure "format string..."
#
# where the format string may have the following keys:
#
#  %=      1-based index
#  %VALUE  the value of the measurement
#  %UNITS  the units for the measurement
#  %x1     atom property "x" for atom 1 
#  %x2     atom property "x" for atom 2
#  %x3     atom property "x" for atom 3
#  %x4     atom property "x" for atom 4
#
# for example:
#
#  measure "%a1 -- %VALUE %UNITS --- %a2"
#
#
# MATH OPERATOR PRECEDENCE AND PARENTHESES
#
# Jmol 11.1.14 supports full standard operator precedence and parentheses
# in IF, SET, and %{} expressions
#
# degUnsat = ({carbon} * 2 + {nitrogen} + 2 - {hydrogen}) / 2
#
#
# BRACES INDICATE ATOM EXPRESSIONS  
#
# Use {} in IF, SET and %{} for designating atom expressions.
# We are still using () for "embedded expressions" in all other commands.
#
#   nOxygen = {oxygen}
#   xOxygen = {oxygen}.x
#   ptOxygen = {oxygen.xyz}
#
#   a = {oxygen}.temperature
#   message %{{carbon}.x}
#   if {O22}.bondCount > 2;goto ...
#
# but
#
#   draw line1 (atomno=2) (atomno=3)
#
#
# ATOM EXPRESSION ITEM SELECTOR [n]
#
# In SET, IF, and %{ } in MESSAGE and ECHO you can now specify a subset of the 
# atom expression. 
#
#  x = {carbon}[3]  # the third carbon atom
#  x = {carbon}[3][5]  # the third through fifth carbon atoms
#  x = {carbon}[3][0]  # the third through last carbon atoms
#
# This also works in standard select expressions, but using () instead:
#
#  select (carbon)[3]  # the third carbon atom
#
# and anywhere an embedded expression might be found:
#
#  measure ((_C)[1]) ((_C)[2])
#
#
# POINTS IN IF, SET, and %{}
#
# Points in IF, SET, and %{} can be designated using the standard {x y z}
# notation WITHOUT commas. This is because we have to distinguish between
# atom expressions {1,2,3} and coordinates {x y z}, and this seems to me the
# simplest way to do it. (Comma means "or" in atom expressions.) In all other
# instances, the commas are fine, including "SET UNITCELL" and "SET DEFAULTLATTICE".  
#
#  x = {1 1 0} + {oxygen}.xyz
#
# {  }.distance ATOM PROPERTY FOR SET, IF, and %{}
#
# d = {oxygen and * /1}.distance{oxygen and * /2}
# set echo top left
# echo the O-O distance is %{{oxygen and * /1}.distance{oxygen and * /2}}
#
# message %{{atomno=3}.distance{atomno=4}}
# message %{{atomno=3}.distance{1/2 1/2 1/2}}
#
#
# {  }.label "xxxx" ATOM PROPERTY FOR IF, SET, and %{}
#
# The .label format provides a convenient means of delivering a wide range of 
# atom-based data back to the user with whatever formatting is desired. 
#
# x2 = {atomno=3).label("atom %a\t" + (atomno=3).xyz)
# xyzFile = "" + {selected}.size + "\n\n" + {selected}.label("%a %x %y %z")
#
#
# "....".lines
#
# The .lines operator splits a string into an array based on line termination. 
#
# WRITE VAR "filename" (application only)
#
# pdbAtomData = {selected and not hetero}.label("ATOM  %5i %-4a%1A%3n %1c%4R%1E   %8.3x%8.3y%8.3z%6.2Q%6.2b          %2e%2C")
# pdbHeteroData =   {selected and hetero}.label("HETATM%5i %-4a%1A%3n %1c%4R%1E   %8.3x%8.3y%8.3z%6.2Q%6.2b          %2e%2C")
# pdbFile = pdbAtomData + pdbHeteroData
# write VAR pdbFile "test.pdb"
#
# molFileData = "line1\nline2\nline3\n"+(""+{selected}.size)%-3+(""+{selected}.bonds.size)%-3+"  0  0  0\n"+{selected}.labels("%-10.4x%-10.4y%-10.4z %2e  0  0  0  0  0")+{selected}.bonds.labels("%3D1%3D2%3ORDER  0  0  0")
#
#
# GETPROPERTY "evaluate"
#
# You can now use getProperty to get expression information directly:
#
#  getproperty "evaluate" "{*}.xyz"
#
# or on a web page the following returns a valid XYZ file for molecule 1:
#
#  var info = jmolGetPropertyAsJavaObject("evaluate", '"" + {molecule=1} + "\n\n" + {molecule=1}.label("%a %x %y %z")')
#
#
# SELECTED ATOMS FROM ATOM EXPRESSIONS
#
# You can select atoms from an atom expression using [n]. 
# "[0]" means "and everything after".
#
#  x = {atom expression}[3].ident
#  x = {atom expression}[3][0].xyz   # 3 and after (average position)
#  x = {atom expression}[3][5].x     # 3-5 (average x)
#
#
# SELECTED BONDS FROM EXPRESSIONS
#
# You can select bonds from an atom expression
#
#  x = {atom expression}.bonds.ident
#  x = {atom expression}.bonds[3].ident
#
#
# BOND INFORMATION
#
# You can specify how to label a set of bonds using format strings.
# Numbers are currently in Angstroms. Keys are 
#
#  %#      sequential number
#  %=      file 1-based index
#  %ORDER  the bond order
#  %TYPE   the bond type
#  %LENGTH the bond length
#  %x1     atom property "x" for atom 1 
#  %x2     atom property "x" for atom 2
#
# The special atom properties %D1 and %D2 give sequential numbers for the
# atoms FOR THIS SET OF BONDS. This is so that a proper subfile of type MOL
# could be generated.
#
# x = {atom expression}.bonds[3].label("%# %3ORDER %TYPE %a1 %a2 %6.3LENGTH") 
#
#
# EXPANDED MODULUS % OPERATOR IN IF, SET, AND %{}
#
# Usually modulus is reserved for integer math, so we
# extend that here to add some useful "modulus-like" capability:
#
#  string modulus for trimming and padding
#    "test" %3  ==> left trim:  "tes"
#    "test" %6  ==> right pad:  "test  "
#    "test" %-3 ==> right trim: "est"
#    "test" %-6 ==> left pad:   "  test"   
#
#  float modulus for rounding and scientific notation
#    3.5456 %3 ==> "3.546"  (STRING!)
#    3545.6 %-3 ==> "3.55E+3" (STRING!)
#
#    0.0 + 3.5456 %3  ==> 3.546 (float)
#    0.0 + 3545.6 %-3 ==> 3550.0
#
#  point modulus for getting base unit cell equivalent position
#    {3/2 1/2 1/1} % 0 ==> {1/2 1/2 0}

# -----------------------------------------------------------------------------

#version=11.1.13:

# DATA "coord set"
# invertSelected POINT ....
# invertSelected PLANE ....
# invertSelected HKL ......
# rotateSelected ....
# rotateSelected spin ....
# full state support for "tainting" atom positions using translateSelected or invertSelected
#
# set allowRotateSelected # then use ALT-LEFT for rotating just the selected molecule
#
# this all definitely needs some work and discussion in terms of user interface via mouse
#
#
# write coords xxxx.spt
# load xxxx.spt # minimal -- just coord.
# script xxxx.spt # this is the full state load
#
# x = (some atom expression).atomProperty  -- takes an average if more than one atom
# for example:
#
#  x = (* /1).temperature
#  x = (C5).bondcount
#
# note that you can even say:
#  set echo top left
#  echo average position= {%{(selected).x},%{(selected).y},%{(selected).z}}
#
# and it will AUTOMATICALLY update with new values as you select different atoms.

# -----------------------------------------------------------------------------

#version=11.1.12:

# app fix for console entry messing up cursor position; 
# allows for scripting during pause or interrupt of running script using ! as first character of script
# new: within(x.x,plane,$plane1)
# fix for "draw off" not recorded in save state
# fix for within(integer,...) bug using RasMol units
# fix for _modelnumber showing up as 2001
# reconfigures _modelNumber as x.y for single models; x.x - y.y for range 
# adds _currentFileNumber
# adds _currentModelNumberInFile
# disallows user setting of variables with _ as first character
# adds @variableName in any command 
# adds frame x.x - y.y
# adds frame 0.0
# adds frame range x.x - y.y
# adds file command
# adds select file=
# tunes select model=
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