Skip to content

error reading lammps dump #1

Description

@GoogleCodeExporter
What steps will reproduce the problem?
1. use dynsf with a custom lammps dump as shown in trajectory_readers.py line 
247 -> ITEM: ATOMS id type x y z vx vy vz
2.
3.

What is the expected output? What do you see instead?

dynsf -f dump.lammpstrj 
WARNING: No output file specified. Results will not be saved
Traceback (most recent call last):
  File "~/.local/bin/dynsf", line 254, in <module>
    2)
  File "~/.local/lib/python2.7/site-packages/dsf/trajectory_readers.py", line 372, in next
    self._get_first()
  File "~/.local/lib/python2.7/site-packages/dsf/trajectory_readers.py", line 337, in _get_first
    self._setup_indexes()
AttributeError: TRJ_reader instance has no attribute '_setup_indexes'

What version of the product are you using? On what operating system?

linux fedora 15

Please provide any additional information below.

looks like _setup_indexes() is not defined

did use:

    def _setup_indexes(self):
            self.indexes=self._x_I

in trajectory_readers.py to correct it, is it right ?

Original issue reported on code.google.com by olivier....@gmail.com on 9 Oct 2012 at 4:16

Attachments:

Metadata

Metadata

Assignees

No one assigned

    Projects

    No projects

    Milestone

    No milestone

    Relationships

    None yet

    Development

    No branches or pull requests

    Issue actions