Bumped to 4.1.0

Makefile

-PYT=python
+PYT=python3
 
 install: 
-	${PYT} setup.py install --user --record files.txt
+	${PYT} setup.py install --user --prefix= --record files.txt
 
 clean: 
 	rm -rf westpy.egg-info

doc/conf.py

@@ -64,7 +64,7 @@ author = u'Marco Govoni'
 # built documents.
 #
 # The short X.Y version.
-version = '4.0.0'
+version = '4.1.0'
 # The full version, including alpha/beta/rc tags.
 release = version
 

setup.py

@@ -5,7 +5,7 @@ with open("README.md", "r") as fh:
     long_description = fh.read()
 
 setup(name='westpy',
-      version='4.0.0',
+      version='4.1.0',
       packages=find_packages(),
       description='Python analysis tools for WEST',
       long_description=long_description,
@@ -25,7 +25,7 @@ setup(name='westpy',
           'signac',
           'setuptools',
           'urllib3', 
-          'prompt-toolkit<2.0.0',
+          'prompt-toolkit',
           'sphinx', 
           'sphinx_rtd_theme'
       ],

westpy/__init__.py

@@ -9,7 +9,7 @@ from westpy.dataContainer import *
 from westpy.electronicStructure import * 
 from westpy.session import *
 
-__version__ = '3.1.1'
+__version__ = '4.1.0'
 
 def header() :
    """Prints welcome header."""

westpy/utils.py

@@ -321,10 +321,10 @@ def write_cube(data, meta, fname):
     
     params:
         data: volumetric data consisting real values
-        meta: dict containing metadata with following keys
-            atoms: list of atoms in the form (mass, [position])
-            org: origin
-            xvec,yvec,zvec: lattice vector basis
+        meta: dict containing metadata with following keys: 
+              - atoms: list of atoms in the form (mass, [position])
+              - org: origin
+              - xvec,yvec,zvec: lattice vector basis
         fname: filename of cubefile (existing files overwritten)
     
     returns: None
@@ -357,9 +357,9 @@ def write_imcube(data, meta, rfname, ifname=""):
     params: 
         data: volumetric data consisting complex values
         meta: dict containing metadata with following keys
-            atoms: list of atoms in the form (mass, [position])
-            org: origin
-            xvec,yvec,zvec: lattice vector basis
+              - atoms: list of atoms in the form (mass, [position])
+              - org: origin
+              - xvec,yvec,zvec: lattice vector basis
         rfname: filename of cube file containing real part
         ifname: optional, filename of cube file containing imag part