Fchl doc

.travis.yml

@@ -7,7 +7,8 @@ group: edge
 
 deploy:
   provider: pages
-  local_dir: ${TRAVIS_BUILD_DIR}/docs/build/html
+  # local_dir: ${TRAVIS_BUILD_DIR}/docs/build/html
+  local_dir: /docs/build/html
   skip_cleanup: true
   repo: qmlcode/qmlcode.github.io
   target_branch: master

docs/source/examples.rst

@@ -261,7 +261,7 @@ The neighbors keyword is the max number of atoms with the cutoff-distance
 Generating the FCHL kernel 
 ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
 
-The following example demonstrates how to calculate the local FCHL kernel elements between FCHL representations. ``X1`` and ``X2`` are numpy arrays with the shape ``(number_compounds,max_size, 5,neighbors)``, as generated in one of the previous examples. You MUST use the same cut-off distance to generate the representation and calculate the kernel.
+The following example demonstrates how to calculate the local FCHL kernel elements between FCHL representations. ``X1`` and ``X2`` are numpy arrays with the shape ``(number_compounds,max_size, 5,neighbors)``, as generated in one of the previous examples. You MUST use the same, or larger, cut-off distance to generate the representation, as to calculate the kernel.
 
 
 .. code:: python

setup.py

@@ -7,7 +7,8 @@
 __copyright__ = "Copyright 2016"
 __credits__ = ["Anders S. Christensen et al. (2016) https://github.com/qmlcode/qml"]
 __license__ = "MIT"
-__version__ = "0.4.0.11"
+__version__ = "0.4.0.12"
+
 __maintainer__ = "Anders S. Christensen"
 __email__ = "andersbiceps@gmail.com"
 __status__ = "Beta"