# 1 "/opt/topspin2.1.4/exp/stan/nmr/lists/pp/user/noesyhsqcfpf3gpsi3d.nus"
;noesyhsqcfpf3gpsi3d
;avance-version (03/06/18)
;NOESY-HSQC
;3D sequence with
;   homonuclear correlation via dipolar coupling
;   dipolar coupling may be due to noe or chemical exchange
;   H-1/X correlation via double inept transfer
;      using sensitivity improvement
;phase sensitive (t1)
;phase sensitive using Echo/Antiecho-TPPI gradient selection (t2)
;with decoupling during acquisition
;using flip-back pulse
;using f3 - channel
;(use parameterset NOESYHSQCFPF3GPSI3D)
;
;O. Zhang, L.E. Kay, J.P. Olivier & J.D. Forman-Kay, 
;   J. Biomol. NMR 4, 845 - 858 (1994)
;A.G. Palmer III, J. Cavanagh, P.E. Wright & M. Rance, J. Magn.
;   Reson. 93, 151-170 (1991)
;L.E. Kay, P. Keifer & T. Saarinen, J. Am. Chem. Soc. 114,
;   10663-5 (1992)
;J. Schleucher, M. Schwendinger, M. Sattler, P. Schmidt, O. Schedletzky,
;   S.J. Glaser, O.W. Sorensen & C. Griesinger, J. Biomol. NMR 4,
;   301-306 (1994)


prosol relations=<triple>


# 1 "/opt/topspin2.1.4/exp/stan/nmr/lists/pp/Avance.incl" 1
;Avance2.incl
;   for 1
;
;avance-version (07/08/21)
;
;$CLASS=HighRes Incl
;$COMMENT=





































































































































;$Id: pulseprogram,v 1.1 2021/02/10 21:36:38 bmrbsvc Exp $
# 30 "/opt/topspin2.1.4/exp/stan/nmr/lists/pp/user/noesyhsqcfpf3gpsi3d.nus" 2

# 1 "/opt/topspin2.1.4/exp/stan/nmr/lists/pp/Grad.incl" 1
;Grad2.incl  -  include file for Gradient Spectroscopy
;   for 1
;
;avance-version (07/01/17)
;
;$CLASS=HighRes Incl
;$COMMENT=



















define list<gradient> EA=<EA>



;$Id: pulseprogram,v 1.1 2021/02/10 21:36:38 bmrbsvc Exp $
# 31 "/opt/topspin2.1.4/exp/stan/nmr/lists/pp/user/noesyhsqcfpf3gpsi3d.nus" 2

# 1 "/opt/topspin2.1.4/exp/stan/nmr/lists/pp/Delay.incl" 1
;Delay.incl  -  include file for commonly used delays
;
;version 00/02/07
;
;$CLASS=HighRes Incl
;$COMMENT=


;general delays

define delay DELTA
define delay DELTA1
define delay DELTA2
define delay DELTA3
define delay DELTA4
define delay DELTA5
define delay DELTA6
define delay DELTA7
define delay DELTA8

define delay TAU
define delay TAU1
define delay TAU2
define delay TAU3
define delay TAU4
define delay TAU5


;delays for centering pulses

define delay CEN_HN1
define delay CEN_HN2
define delay CEN_HN3
define delay CEN_HC1
define delay CEN_HC2
define delay CEN_HC3
define delay CEN_HC4
define delay CEN_HP1
define delay CEN_HP2
define delay CEN_CN1
define delay CEN_CN2
define delay CEN_CN3
define delay CEN_CN4
define delay CEN_CP1
define delay CEN_CP2


;loop counters

define loopcounter COUNTER
define loopcounter SCALEF
define loopcounter FACTOR1
define loopcounter FACTOR2
define loopcounter FACTOR3



;$Id: pulseprogram,v 1.1 2021/02/10 21:36:38 bmrbsvc Exp $
# 32 "/opt/topspin2.1.4/exp/stan/nmr/lists/pp/user/noesyhsqcfpf3gpsi3d.nus" 2

;********Added for NUS*******
define delay short
"short=50u"
"l2=td2/2"
"l3=td1/2"
;****************************


"p2=p1*2"

"p22=p21*2"

"d0=3u"

"d10=3u"

"d11=50m"

"d12=20u"

"d13=4u"

"d26=1s/(cnst4*4)"


"p19=300u"

"in0=inf1/2"
"in10=inf2/2"


"DELTA1=d13+p19+d16+4u"
"DELTA3=d24-p16-d16"
"DELTA4=d26-p16-d16"


"DELTA=p16+d16+larger(p2,p8)+d10*2"
"DELTA2=larger(p8,p22)+d0*2"





"TAU=d8-p16-d16"


aqseq 321


# 1 "mc_line 82 file /opt/topspin2.1.4/exp/stan/nmr/lists/pp/user/noesyhsqcfpf3gpsi3d.nus dc-measurement inserted automatically"
    dccorr
# 82 "/opt/topspin2.1.4/exp/stan/nmr/lists/pp/user/noesyhsqcfpf3gpsi3d.nus"
1 ze
  d11 pl16:f3
2	d11 do:f3
	short*4
3	short*5
4	1u
if "vd < 2u" goto 100
	short*6
5	short*1
6	5u
	d11 do:f3
	d12
  d1 
  (p1 ph8)
  DELTA2 pl3:f3
  (p2 ph9)
  d0


  (center (p8:sp13 ph1):f2 (p22 ph1):f3 )




  d0
  (p1 ph10)
  TAU setnmr3|0 setnmr0|34|32|33 ctrlgrad 0
  p16:gp1
  d16
  (p1 ph11)
  d26
  (center (p2 ph1) (p22 ph6):f3 )
  d26
  (p1 ph2) 

  4u pl0:f1
  (p11:sp1 ph12):f1
  4u
  p16:gp2
  d16 pl1:f1

  (p21 ph3):f3
  d10 


  (center (p2 ph7) (p8:sp13 ph1):f2 )




  d10
  p16:gp3*EA
  d16
  (p22 ph4):f3
  DELTA
  (center (p1 ph1) (p21 ph4):f3 )
  p16:gp4
  d16
  DELTA3
  (center (p2 ph1) (p22 ph1):f3 )
  DELTA3
  p16:gp4
  d16
  (center (p1 ph2) (p21 ph5):f3 )
  p16:gp5
  d16
  DELTA4
  (center (p2 ph1) (p22 ph1):f3 )
  DELTA4
  p16:gp5
  d16
  (p1 ph1)
  DELTA1
  (p2 ph1)
  d13
  p19:gp6
  d16 pl16:f3
  4u setnmr3^0 setnmr0^34^32^33 ctrlgrad 7
  go=2 ph31 cpd3:f3
;**************************************************
	d11 do:f3 wr #0 
100  short if #0 
  short zd
;**************************************************
	short igrad EA
	short ip5*2
lo to 3 times 2
	short id10
	short ip3*2
	short ip6*2
	short ip31*2
	short ivd
lo to 4 times l2
	short rd10
	short ip8
	short ip9
	short rp3
	short rp6
	short rp31
lo to 5 times 2
	short id0
lo to 6 times l3
1m

;	d11 do:f3 mc #0 to 2
;	F1PH(rd10 & ip8 & ip9, id0)
;	F2EA(igrad EA & ip5*2, id10 & ip3*2 & ip6*2 & ip31*2)
exit
   

ph1=0 
ph2=1
ph3=0 2
ph4=0 0 2 2
ph5=1 1 3 3
ph6=0
ph7=0 0 2 2
ph8=0 0 0 0 2 2 2 2
ph9=1 1 1 1 3 3 3 3
ph10=0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0
     2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2
ph11=0 0 0 0 0 0 0 0 2 2 2 2 2 2 2 2
ph12=2 2 2 2 2 2 2 2 0 0 0 0 0 0 0 0
ph31=0 2 2 0 2 0 0 2 2 0 0 2 0 2 2 0
     2 0 0 2 0 2 2 0 0 2 2 0 2 0 0 2
 

;pl0 : 120dB
;pl1 : f1 channel - power level for pulse (default)
;pl3 : f3 channel - power level for pulse (default)
;pl16: f3 channel - power level for CPD/BB decoupling
;sp1 : f1 channel - shaped pulse  90 degree
;sp13: f2 channel - shaped pulse 180 degree (adiabatic)
;p1 : f1 channel -  90 degree high power pulse
;p2 : f1 channel - 180 degree high power pulse
;p8 : f2 channel - 180 degree shaped pulse for inversion (adiabatic)
;p11: f1 channel -  90 degree shaped pulse
;p16: homospoil/gradient pulse                         [1 msec]
;p19: homospoil/gradient pulse                         [300 usec]
;p21: f3 channel -  90 degree high power pulse
;p22: f3 channel - 180 degree high power pulse
;d0 : incremented delay (F1 in 3D)                     [3 usec]
;d1 : relaxation delay; 1-5 * T1
;d8 : mixing time
;d10: incremented delay (F2 in 3D)                     [3 usec]
;d11: delay for disk I/O                               [30 msec]
;d12: delay for power switching                        [20 usec]
;d13: short delay                                      [4 usec]
;d16: delay for homospoil/gradient recovery
;d24: 1/(4J)YH for YH
;     1/(8J)YH for all multiplicities
;d26: 1/(4J(YH))
;cnst4: = J(YH)
;in0: 1/(2 * SW(H)) = DW(H)
;nd0: 2
;in10: 1/(2 * SW(X)) = DW(X)
;nd10: 2
;NS: 8 * n
;DS: >= 16
;td1: number of experiments in F1
;td2: number of experiments in F2
;FnMODE: States-TPPI (or TPPI) in F1
;FnMODE: echo-antiecho in F2
;cpd3: decoupling according to sequence defined by cpdprg3
;pcpd3: f3 channel - 90 degree pulse for decoupling sequence


;use gradient ratio:	gp 1 : gp 2 : gp 3 :  gp 4 : gp 5 : gp 6
;			  30 :  -50 :   80 :    11 :    5 : 8.1*x

;   with x = p16/p19

;for z-only gradients:
;gpz1: 30%
;gpz2: -50%
;gpz3: 80%
;gpz4: 11%
;gpz5: 5%
;gpz6: 27% (8.1% *p16(=1 ms)/p19(=300 us))

;use gradient files:
;gpnam1: SINE.100
;gpnam2: SINE.100
;gpnam3: SINE.100
;gpnam4: SINE.100
;gpnam5: SINE.100
;gpnam6: SINE.50


                                          ;preprocessor-flags-start
;1: for C-13 and N-15 labeled samples start experiment with 
;             option -DLABEL_CN (eda: ZGOPTNS)
                                          ;preprocessor-flags-end



;$Id: pulseprogram,v 1.1 2021/02/10 21:36:38 bmrbsvc Exp $