1. Trang chủ
  2. » Ngoại Ngữ

Computational study on macro biological active molecules

203 76 0

Đang tải... (xem toàn văn)

Tài liệu hạn chế xem trước, để xem đầy đủ mời bạn chọn Tải xuống

THÔNG TIN TÀI LIỆU

Thông tin cơ bản

Định dạng
Số trang 203
Dung lượng 2,15 MB

Các công cụ chuyển đổi và chỉnh sửa cho tài liệu này

Nội dung

Trang 1

 



Trang 3

 $% &'( )#*' & +, -#. .'#( &'(+.&#/ & *00 +11(. 

)0&  2'20'  3#+ $% '+#+4

Trang 4

 )0& 0#5'  '61('++ $% +#'(' 5+ & /(.#.&'  $% +1'(7#+(+

++#.' (*'++( '/  #/ &++#.' (*'++( "' 8/ *(

.'#( /#&' &7#' & &'(+.&#/ &(#/ ' (+' * )(5,

% /(.#.&' 0+'6.'&+  (*  8#9#'*( 1(7#&#/$')#. +$10'+,

Trang 5

.(' /(''+ 7'(% )'00 )#. :>(% &#=(.#&., & +1'.( * '

?@&##.(&#2'2($0#$2#+0*.')'('2.#'&'61'(#$'.00%&#.+*>

&$'.07#2(.#+)'('++#/'&&$1('&)#..'.'('.#01('&#.#+,

Trang 6

.#'+ * ' ?>&##.(&#2'2($#$ .# )'(' *(.'( +.&#'& +#/ 3(+.

1(##10'+$'.&+2+'&.'&'+#.%*.#0.'(% !#='('.*($+

* '6/' & (('0.# *.#+ & 2+#+ +'.+ )'(' +#&'('& & '#(

+#.2#0#.% # +.&%#/ + 0(/' $0'0' )'(' ++'++'& 2% $1(#/ ' 0>

0.'&('+0.+)#.  #020' %&#=(.#&., ' ('+0.+)'(' 0+

$1('& )#. +' 2.#'& +#/ ' 5 $'.&, ' $'.>

&+)'('*&.#$1(7'1.'00.'& & +1'.(3($#/

.' +1'(#(#.% * ' $'.&+ '(.' $'.&#1('&#.#/($#

*('<'#'+1(.#0(0%*((/##.($1&+, '/'$'.(# 1($'.'(+

2.#'& +#/ ' %2(#& $'.&+ + +   AB& -C

(' $1.#20' )#. ' ('+0.+ * ' $'.&,

'+#&'+.'.##*($+#&'('&#.' & +.&#'+.'+.(.('

* ' ?>&##.(&#2'2($#$0(#&'#+ 1.#$#'& #(&'( #7'+.#/.'

.' '=' * ' #  ' +.(.(' & 1(1'(.#'+ * ' .#, 0#/.0%

&#='('.+.(.('+)'(' 1.#$#'&&'(&#='('.+%$$'.(%+.(#.+&.'

+.(.('+ )#. ' & +%$$'.(% #+ 1('&#.'&  2' #&'.#0 & 7'

0(#&' (' 0$+ ' +$' +.+' *.' .#, (.'(+.&#'+ )'(' ((#'&

 . 2.# '0'.(# &'+#.% '0'.(+..# 1.'.#0 & (/' &#+.(#2.#

* ' 0(#&' & ' .# # #.+ 10( *($ & )#. ' (..# * '

Trang 7

.' '0'.( &#+.(#2.#+ * '+' ) +..'+ 7' 2'' #7'+.#/.'& & $>

1('& )#. +' * ' /(& +..',  )+ *&  .' '0'.( '6#..#

('+.&#'&+#/ $'.&#(&'(.#7'+.#/.'.'2#0/#0.#7#.#'+&

$'#+$+ * '+' $1&+ #.'(.#/ )#. !  +.(&+,  )+ *&

Trang 8

!  +.(&)#+' ' &$/'* ' 0.'(,  )+ *&  #.( /(1

Trang 14

/0

Trang 17

C, ''0'.(&'+#.%&#='(''2'.)''.' '6#.'&+..'.,EF

' & ' /(& +..' ' ('& 0( ('1('+'.+ ' (' #

)# ' '0'.( &'+#.% * ' '6#.'& +..' #+#/'(  

* ' /(&+..' & ' 20' 0(('1('+'.+ ' 11+#.', , FF

C,E ''0'.(&'+#.%&#='(''2'.)''.' '6#.'&+..'.E,EE?B

' & ' /(& +..' ' ('& 0( ('1('+'.+ ' (' #

)# ' '0'.( &'+#.% * ' '6#.'& +..' #+#/'(  

* ' /(&+..' & ' 20' 0(('1('+'.+ ' 11+#.', , FB

C,F ' &#10'$$'.* ' /(& +..' & ' '6#.'& +..'+

.E,EE?B ' 2 & ,EF ', , , , , , , , , , , , , , , , , , F?

, ' (('0.# * 1(#2#.#(.' )#.'0'.(# 1(1'(.#'+ , , , BB

, ' 1.#$#'& +.(.('+ * ' (&#0+ & '#( +1# &'+#.%

10.+H ' 10.+ * +1# &'+#.% )'(' 5' # ' 10'+  )#

.' #/'+ +1# &'+#.% 700'+(' *& , , , , , , , , , , , , , , ?

Trang 18

, =' * #&#$ '.'(%0# $1&+ & #.+ 1('&''++(+

Trang 19

B,? "$1(#++2'.)'' ' 00.'&& ' '61'(#$'.0 &

Trang 20

A, !#+10% *.' ! .( 10.+ *'0'.( &'+#.% .' 2'#

10' )'#.( /(1+ (..' , , , , , , , , , , , , , , , , , , , ?

A, !#+10% * + *( $0'0'+ )#. (..'& #.( /(1 , , , , 

C, 6#.'& +..'+ 00.'& #&#='(' +%$$'.(%/(1+ , , , , , , E?

C, "3/(.#+*.' '6#.'&+..'+00.'& #&#='('.+%$$'>

+%$$'.(#+.('. * #.( /(1 $/.' &#='(' $'.&+, , FE

, !#1''0'' & &#1'%0 #&#$.#+ , , , , , , , , , , , , B

, (1+* (&#$'.'(%0# $1&+ , , , , , , , , , , , BE

, '1.#$#'&+.(.('+'0'.(+..#1.'.#0+(*'('1('+'.'&

#&#='('.0( & $6#$$ & $##$$ 70' .' +(*',B?

,E 0'.(Æ#.% * #&#$'.'(%0# $1&+ , , , , , , , ?

,F !#1''0'' & &#1'%0 #&#$$1&+ , , , , , , , , , , ?E

,B "$1(#+*2&0'/. 

D

 *(+.(.('+ #/(&+..' &

Trang 21

  

' +.&% * 0#$ '.'(%0# $1&+ + 2''  (' * .#7' ('>

+'( *(&'&'+ &' .'#( #<' +.(.(' &7(#+2#0/#0.#7#.#'+,

(/' $2'( * #&#$ & 2($#$ '.'(%0# $1&+ 7' 2''

+%.'+#'& & '#( +.(.(' 1(1'(.#'+ + )'00 + 2#0/#0 .#7#.#'+ 7'

2'' (.'(#'&& '610('&,

'+.&%*.'#&#$'.'(%0#$1&+2'.('&25.+'(0%

+C )' +('00#MN+%.'+#'& ' 3(+ %1'(>70'.#&#'$1&,

#' ' &#='(' $1&+ 7' 2'' +%.'+#'& & ('+'( + 2''

*+'&  '610(#/ +%.'.# $'.&+ * ') $1&+ & (.'(##/

Trang 22

.'#( +.(.('+ & 1(1'(.#'+ MN,

CFB$'.&*(+%.'+##/#&#$'.'(%0#$1&+)++>

'++*00% &'7'01'& 2% / MEN, "$1('&  .'( '#<'+ #+ $'.&

#('+'+ +1''& * 1(&.# )#0' ('&'+ ' + * +%.'+##/ + $>

1&+ MF@?N, #0/#0 .#7#.% '+.+ & +)  .'+' #&#$ '.'(>

%0# $1&+ 1++'++ 7(#+ 5#&+ * 2#0/#0 .#7#.#'+MA@N, ('6$>

Trang 23

20' ,G =' * #&#$ '.'(%0# $1&+ & #.+ 1('&''++(+ &

#'&, #0/#0.#7#.#'+ * '+' $1&+)'(' &#+7'('& (/ +'(#'+ *

2#0/#0.#7#.%.'+.+, 20',)'0#+ '$1&+*($'&2% 'B>&#>

&#$'.%0$#&#2'1%(#&#$.# , & 7(#+ #+&

.'#( 2#0/#0.#7#.#'+,

Trang 24

I N(CH 3 ) 2 (H 3 C) 2 N

Trang 25

2+'<' +.&#'+.' +.(.(' & 1(1'(.#'+ *.#+ $1&*& .

.' ')0% +%.'+#'& 2($#$ '.'(%0# $1&+  &($.#00% #>

('+' ' $#' #$$*.#+ MEN, ' ('.# * #+ +1'#'+ )#. '

.'( '$#0+ + + 0'1#0# ('/' )+ 0+ ((#'&  MF@AN, *>

.'( #+ .'( %1'+ * ' '.'(%0# 2($#$ $1&+ 7' 0+ 2''

Trang 26

N N

1( *($ ' 2 ' ('1(.'& 0#$ '.'(%0# $1&+ &#1'%0''>

2($#$!MEN&#1'%0''#&#$!MEN&>#.(&#1'%0''>

#&#$ !MEEN)'('0++%.'+#'&#.'CB+&C?+, '#(2#0/#>

0.#7#.#'+)'('0+#7'+.#/.'&, !#1'%0''#&#$)+('1(.'&.##2#

.' 2#<#' & $'&#' ('&.+' .#7#.#'+ * ' $#.&(#0!! >

2#<#' 6#&('&.+'MEFN, '7'(0 .'(S71(.'#+)'(' 0+('1(.'&.

2'+'+#.#7'.!& $/.'$(' !! 6#&+'* 1/%.'+ MEBE?N

#.(# 6#&' +%.+' MEAN 6.#' 6#&+' & ! >+%.($' >EF ('>

&.+' MECN, R&'( MFN &'$+.(.'&  .' ! #+  0%  #<'

##2#.(*"$10'6 2.#.$#/.0+2'+'*0('/' +.&%.' 1(.'#>

2& *7# & ' '0'.( #1 &$# *.' '%$',

' $'#+$* 2#0/#0.#7#.#'+ )+0+#7'+.#/.'&, K '.0,MFN

('1(.'&  !  1('7' '(0% 00>#&'& 0#7'(#R(% $+ 0#5'0% 2%

Trang 27

7+5## MF@FEN *&  !#1'%0''0#$ !  .#+ ('

.' 3(+ !  #.'(0.(+  (' 20'  7'( ###/ (&#.#('.#7#.%

1.)   6#&.#7' +.(& 0'7/', ! .#+ )'(' *&  &'(/

'>'0'.(('&.#+ 2% 7(#+/'.+& 1.'$#00% #S#&+0.#+

('0'+#/ #/0% ('.#7' 1'%0 (&#0+, ' (%0 (&#0+ /''(.'&  +'(7'

&'  ' +#' * ' 2($#' & #&#',  &.' 7+5## MFN ((#'&

.00.#+2+'&+'$#>'$1#(#0&&'+#.%*.#0.'(%.#7'+.#>

/.'.'$#+$*.'! +.(&2('5#&'&2%.' '>'0'.(>('&'&

! &#1'%0''2($#$!H&#1'%0''#&#$!&>#.(!

Trang 28

0/''.'(%0#$1&+('1('+'.'&, '$'.(#0&'0'.(#+.(>

.(' & *('<'#'+ & ' '6#.'& +..' * '+' $1&+ ('

Trang 29

+.(.(' & ' & *('<'#'+ *  ?>&##.(&#2'2($#$

.#,  "1.'( ? !'+#.% .#0 '(% $'.& )#00 2' +'&  #7'+>

.#/.' ' +.(.(' & 7#2(.#01(1'(.#'+ *  ?>&##.(&#2'2($#$

.#& 0(#&'.' ('+0.+(' $1('& )#..' ('+0.+2.#'& +#/.'

5 $'.& & '61'(#$'.0 $'+('$'. $'(#.+ * &#='('

$'.&+ (' &#+++'&,  "1.'( A ' $'.&+ )#002' +'& #7'+.#>

$1&+,   '$1 #+ $&'  +'& 0#/  +.(.(0 *'.('+ * '+'

$1&+ & ' $'#+$ * '+' $1&+ #.'(.#/ )#. ' ! 

+.(&+, ' 00.'& 1(1'(.#'+ *  /(1 * &#1'%0''#&#$ .#+

&  /(1 * &#1'%0#&#$ $1&+ (' $1('& # (&'(  1(7#&'

1%+#0#+#/ #..' +.(.('>.#7#.% ('0.#+#1* '+' $1&+,

' 0+ +'.# * #+ '+#+ #+  +$$(% * ' 1(R' &  .0#' *

Trang 37

0'# (' $ '7#'(  '0'.(+  1(. #+ AB #$'+ '7#'(  

'0'.( '%7'$0(/'(#'(.#.'0'.(+ & )' +#&'(.

.' '0'.(+ )#00&R+ .'#( 1+#.#+ #+..0% )''7'( ' 0'# $7', -'

Trang 38

,

+ )' 7' +'& ' .$##.+ # ' 2 ' '<.# ' 1%+#0 +..+

&.11'(# <,,, '+'&.'($.#+0'((&#.'+ &#.+

.(#2.#  ' '<.# #+ &#='(' *( &#='(' &#+.(#2.#+ * ' 0'#

+ )' +00 2.# &#='(' +0.#+ *(  & T,  #+ 0'(  .' &#='(''

Trang 39

#+ $#0.# #+ +'& # ' (I&#/'( '<.# *( 0'( $.# &

Trang 44

B>V&1 2+#+ +' #+ +.(.'& *($ ' &'(0%#/ B>OO ('1('+'.>

.#+ 2% ' &&#.#*  +#/0' +' * &#=+' /++# & 1>.%1' *.#+,

Trang 45



W



9

8





9

' 7(#.#0 $'.& $% 2' 110#'&  &'.'($#' ' 1.#$$ (2#.0+

;



V

V



#+ ' 1.'.#0''(/%  .' '<#0#2(#$ 0'( 3/(.# & ' '6>

Trang 46

 '($'& <&(.# *(' +..+ (' ' +'& &'(#7.#7'+ * ' 1>

.'.#0''(/% )#. ('+1' . $++>)'#/.'& (.'+# &#+10'$'.+ '70.'&

 ' '<#0#2(#$0'( 3/(.#  #+

%

Q

(2%&#('.0%.#0+'&&#='('.#.# <, ,B, '#'*1('&('

&'1'&+.' <.$ $'#0$&'0'$10%'& .#++#/0'>&'.'($#

Trang 47

%&'3#.# +.(.(' )#+  #$/#(%*('<'#'+#+ 

!

(&'(+&>

&0' 1#., + (&#(% (+#.# +.(.(' #+ +00% (.'(#'& 2% '

#$/#(% *('<'#'+ +#' '% (' 3(+ (&'( +&&0' 1#., ' 00.'&

($0>$&' 7#2(.#0 *('<'#'+ 0+ 1(7#&' '($&%$# 1(1'(.#'+ *

Trang 48



#+ #+'<#70' '6#.#/ ' '0'.( #/'( ''(/%(2#.0, .' "

$'.& #+ 0++'& '610(' ' '6#.'& +..' * $0'0'+,

  (&-" "!.)1#'& (2#.0+(' ('10'& 2% 7#(.0

V



,

Trang 49

 *00 " $'.& *($+ ' ) '*.# T +  0#'( $2#.# * '

5 &'.'($# & 00 1++#20' +2+.#..'& &'.'($#.,  *00 "

$'.& #+ )'00>&'3'& +#'>+#+.'. & 7(#.#0, )'7'( # #+ 7'(% '6>

1'+#7' & #$1(.#0 *( 002 .' 7'(% +$00+%+.'$+,

' 1(.#03/(.##.'(.#$'.&/$' ' 5 2%

&&#/0%  0#$#.'&+'.+ * +2+.#..#+ (.#/ ' "'61+# .+$'

0'7'0 * +2+.#..#, 1( *($.' 2 '" & "! " ! &&+ +#/0' &

&20' '6#..# & " ! &&+ +#/0' &20' & (#10' '6#..#+ & +





V=W

Trang 50

(('0.# $'.&+ )'(' *($0.'& 2% +' #/ ' 1($'.'( =Q  & 2%

.(.# * ' +'(#'+ # <, ,E 7(#+ (&'(+, -' ('*'(. ' $'.&+

2% ' #/'+.>(&'(''(/% '($ 00)'&  #. (.# *.'( +'&>(&'(

Trang 52

5) $&'0)+&'7'01'& 2% $+ MN& '($# MN,

!#(MN$&'#$1(7'$' .' '($# $&'02% #.(&#/

*($0 *( ' '6/' ''(/% *  #*($ '0'.( /+, ' '($#>

!#( $'.& 0./ #/0%11(6#$.' )+ 110#'& MEFN )#&'0% # .$#

1%+#+ + '1.00% +'*0 & $1..#00%'61'&#' $&'0,

#.+(#/# #+0#&>+..'1%+#+, ' $'.&'$'(/'& *($.' )(5 * 0.'(MBN

)#CF 1(1+'&  ' '6/'>(('0.#1.'.#0 2'('1('+'.'&

Trang 53

2%*.#)##+1(1(.#0..' 1)'(*.''0'.( &'+#.%, #+

11(6#$.# '707'&  * ' ''&  &'7'01 '#<'+  )'(' 20' 

&0'+0#&+)#.# ('+20'.#$'*($',  +2'' )#&'0% +'&&(#/.'

+2+'<' &'&'+ & $+'*0 #*($.#+ 2'' 2.#'& )#. #.M?N,

Trang 54

).' *.#0 M N 2'$'+

M N Q M ... class="page_container" data-page="8">

!  +.(&)#+'' '' &$/''* '' 0.''(,  )+ *&  #.( /(1

Trang 14

, ='' * #&#$ ''.''(%0# $1&+ & #.+ 1(''&''''++(+

Trang 19

I N(CH 3 ) 2 (H 3 C) 2 N

Trang 25

Ngày đăng: 15/09/2015, 22:19

TÀI LIỆU CÙNG NGƯỜI DÙNG

TÀI LIỆU LIÊN QUAN