Logo

TRAVIS – Trajectory Analyzer and Visualizer

TRAVIS

TRAVIS, which stands for Trajectory Analyzer and Visualizer, is a software tool which can compute a plethora of functions and histograms from molecular dynamics and Monte Carlo simulation trajectories. I am the main developer of the TRAVIS program package.

Please visit the TRAVIS website:  www.travis-analyzer.de

In April 2020, our new open access article on TRAVIS has been published. It describes many of the new features and algorithms which have been added to TRAVIS within the last nine years. Please have a look:

M. Brehm, M. Thomas, S. Gehrke, B. Kirchner:
“TRAVIS – A Free Analyzer for Trajectories from Molecular Simulation”,
J. Chem. Phys. 2020, 152 (16), 164105, DOI 10.1063/5.0005078.

Please see also our new tutorial on computing vibrational spectra with CP2k and TRAVIS (Oct 2018).


— Work Citing TRAVIS —

This is a list of publications which cite the original TRAVIS article from 2011. Currently, there are 539 such publications, written by 1201 different authors.
512 out of these (94.99 %) actually used TRAVIS for results in the manuscript.

Only showing results by author “Chattaraj, K. G.”. Show all citations.

Go to Author List, go to Journal List.

6 citations match the query.  Show continuous list view.

— 2020 —

6 K. G. Chattaraj, S. Paul:
"Investigation on the Mechanisms of Synchronous Interaction of K3Cit with Melamine and Uric Acid That Avoids the Formation of Large Clusters"
J. Chem. Inf. Model. 2020, 60 (10), 4827–4844.     (DOI 10.1021/acs.jcim.0c00384 ) ⭳ Bib
Uses TRAVIS for SDF.
5 K. G. Chattaraj, R. Paul, S. Paul:
"Switching of Self-Assembly to Solvent-Assisted Assembly of Molecular Motor: Unveiling the Mechanisms of Dynamic Control on Solvent Exchange"
Langmuir 2020, 36 (7), 1773–1792.     (DOI 10.1021/acs.langmuir.9b03718 ) ⭳ Bib
Uses TRAVIS for SDF.

— 2019 —

4 K. G. Chattaraj, S. Paul:
"How Does Temperature Modulate the Structural Properties of Aggregated Melamine in Aqueous Solution—An Answer from Classical Molecular Dynamics Simulation"
J. Chem. Phys. 2019, 150 (6), 64501.     (DOI 10.1063/1.5066388 ) ⭳ Bib
Uses TRAVIS for SDF, Aggr.
3 K. G. Chattaraj, S. Paul:
"Underlying Mechanistic Insights into the Structural Properties of Melamine and Uric Acid Complexes with Compositional Variation under Ambient Conditions"
J. Chem. Phys. 2019, 151 (5), 54503.     (DOI 10.1063/1.5094220 ) ⭳ Bib
Uses TRAVIS for SDF.
2 K. G. Chattaraj, S. Paul:
"Inclusion of Theobromine Modifies Uric Acid Aggregation with Possible Changes in Melamine–Uric Acid Clusters Responsible for Kidney Stones"
J. Phys. Chem. B 2019, 123 (49), 10483–10504.     (DOI 10.1021/acs.jpcb.9b08487 ) ⭳ Bib
Uses TRAVIS for CDF, Aggr.

— 2018 —

1 K. G. Chattaraj, S. Paul:
"Understanding of Structure and Thermodynamics of Melamine Association in Aqueous Solution from a Unified Theoretical and Experimental Approach"
J. Chem. Inf. Model. 2018, 58 (8), 1610–1624.     (DOI 10.1021/acs.jcim.8b00231 ) ⭳ Bib
Uses TRAVIS for Aggr.


— Author List —

Go to Article List, go to Journal List.

3 different authors contributed to the 6 articles shown above.

Citations ↓ A–ZAuthor Name ↓ A–Z
6(show)Chattaraj, K. G.
6(show)Paul, S.
1(show)Paul, R.

— Journal List —

Go to Article List, go to Author List.

The 6 articles shown above were published in 4 different journals.

CitationsJournal Name
2(show)J. Chem. Inf. Model.
2(show)J. Chem. Phys.
1(show)J. Phys. Chem. B
1(show)Langmuir