aboutsummaryrefslogtreecommitdiff
path: root/doc/man/check_hkl.1
diff options
context:
space:
mode:
authorThomas White <taw@physics.org>2014-04-03 11:45:41 +0200
committerThomas White <taw@physics.org>2014-04-03 12:54:37 +0200
commitef7f6088d3b59ed8c346c5d20a8c534e6bf041f8 (patch)
tree17b8b715abfe77435ed4280eceb3ece37e393346 /doc/man/check_hkl.1
parent1e7a4f59997dea30d0b7aa720684d82fd0d3c9c0 (diff)
check_hkl: Fix the FIXMEs and calculate B factor
Diffstat (limited to 'doc/man/check_hkl.1')
-rw-r--r--doc/man/check_hkl.121
1 files changed, 21 insertions, 0 deletions
diff --git a/doc/man/check_hkl.1 b/doc/man/check_hkl.1
index a0c77566..97787e3b 100644
--- a/doc/man/check_hkl.1
+++ b/doc/man/check_hkl.1
@@ -51,6 +51,27 @@ Fix the upper resolution limit for the resolutions shells, as 1/d in m^-1.
.PD
Write the statistics in resolution shells to \fIfilename\fR.
+.PD 0
+.IP \fB--ltest\fR
+.PD
+Perform an L-test for twinning. The shell file will contain the values of |L|, N(|L|) and the theoretical values for untwinned and perfectly twinned data. See Padilla and Yeates, Acta Cryst. D59 (2003) p1124.
+
+.PD 0
+.IP \fB--wilson\fR
+.PD
+Calculate a Wilson plot. The shell file will contain the values of s^2 and ln(<I>/eE) (and also the shell number and d in Angstroms for your convenience). The B factor will be calculated using data above 3.2 A resolution and displayed on the terminal.
+
+.PD 0
+.IP \fB--ignore-negs\fR
+.PD
+Ignore reflections with negative intensities.
+
+.PD 0
+.IP \fB--zero-negs\fR
+.PD
+Set to zero the intensities of reflections with negative intensities.
+
+
.SH AUTHOR
This page was written by Thomas White.