|
View:
New views
1 Messages
—
Rating Filter:
Alert me
|
|
|
CNS ERROR: "Error: required observed amplitude array "fobs" does not exist"Hi,
I am trying to run 'translation.inp', part of molecular replacement for a DNA using CNS version 1.1 on a SGI machine. cross_rotation.inp job runs and gives the output. However, translation.inp gives the error message (please scroll down): ============================================================ | | | Crystallography & NMR System (CNS) | | CNSsolve | | | ============================================================ Version: 1.1 Status: General release ============================================================ Written by: A.T.Brunger, P.D.Adams, G.M.Clore, W.L.DeLano, P.Gros, R.W.Grosse-Kunstleve, J.-S.Jiang, J.Kuszewski, M.Nilges, N.S.Pannu, R.J.Read, L.M.Rice, T.Simonson, G.L.Warren. Copyright (c) 1997-2001 Yale University ============================================================ Running on machine: test1 (SGI/IRIX,64-bit) Program started by: pradeep Program started at: 18:06:35 on 22-Jan-08 ============================================================ FFT3C: Using complib.sgimath . . . . . . CNSsolve> if ( &BLANK%anom_library = false ) then NEXTCD: condition evaluated as false CNSsolve> @@&anom_library CNSsolve> else CNSsolve> set echo=off end ANOMalous=FALSe {OFF} NEXTCD: condition evaluated as false CNSsolve> end if CNSsolve> CNSsolve> xray XRAY> XRAY> set echo=off end NEXTCD: condition evaluated as false Reciprocal space object FOBS does not exist. NEXTCD: condition evaluated as true ************************************************************** Error: required observed amplitude array "fobs" does not exist ************************************************************** % error encountered: ABORT statement specified. (CNS is in mode: SET ABORT=NORMal END) ***************************************************** ABORT mode will terminate program execution. ***************************************************** Program will stop immediately. ============================================================ Maximum dynamic memory allocation: 1724448 bytes Maximum dynamic memory overhead: 352 bytes Program started at: 15:30:08 on 22-Jan-2008 Program stopped at: 15:30:09 on 22-Jan-2008 CPU time used: 0.0990 seconds ============================================================ I tried running the steps (cross_rotation and translation) with a known data set, and it gives the same error. [The molecular replacement solution was obtained originally in CNS (version 1.0), that have been refined to 1.1A]. The header of the hkl file reads: NREFlections= 18313 ANOMalous= FALSe DECLare NAME=IOBS DOMAin=RECIprocal TYPE=REAL END DECLare NAME=SIGI DOMAin=RECIprocal TYPE=REAL END DECLare NAME=FOBS DOMAin=RECIprocal TYPE=REAL END DECLare NAME=SIGMA DOMAin=RECIprocal TYPE=REAL END INDEx= 0 0 2 IOBS= 437675.00 SIGI= 25406.00 FOBS= 661.57 SIGMA= 19.49 INDEx= 0 0 4 IOBS= 19968.30 SIGI= 712.90 FOBS= 141.31 SIGMA= 2.55 INDEx= 0 0 10 IOBS= 112547.00 SIGI= 3318.00 I don't know where the problem lies. If anyone knows, can you please suggest a possible remedy? Thanks very much, Pradeep _______________________________________________ X-plor mailing list X-plor@... http://www.bio.net/biomail/listinfo/x-plor |
| Free embeddable forum powered by Nabble | Forum Help |