TRAVIS – Trajectory Analyzer and Visualizer


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 —

Only showing results by author “Cui, P.”. Show all citations.

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3 citations match the query.  Show sub-lists per year.

3 J. Xing, Y. Qu, Z. Su, M. Zhou, C. Sun, Y. Wang, P. Cui:
"Phase Equilibria and Mechanism Insights into the Separation of Isopropyl Acetate and Methanol by Deep Eutectic Solvents"
Ind. Eng. Chem. Res. 2022, 61 (51), 18881–18893.     (DOI 10.1021/acs.iecr.2c03488 ) ⭳ Bib
2 X. Liu, J. Xing, M. Sun, Z. Su, Z. Chen, Y. Wang, P. Cui:
"Phase Behavior and Extraction Mechanism of Methanol-n-Hexane Separation Using Choline-Based Deep Eutectic Solvent"
J. Mol. Liq. 2022, 345, 118204.     (DOI 10.1016/j.molliq.2021.118204 ) ⭳ Bib
1 Z. Zhang, X. Liu, D. Yao, Z. Ma, J. Zhao, W. Zhang, P. Cui, M. Yixin, Z. Zhu, Y. Wang:
"Molecular Kinetic Extraction Mechanism Analysis of 1-Butanol from n-Heptane-1-Butanol by Choline-Based DESs as Extractants"
J. Mol. Liq. 2021, 322, 114665.     (DOI 10.1016/j.molliq.2020.114665 ) ⭳ Bib
Uses TRAVIS for SDF.

— Author List —

Only showing results by author “Cui, P.”. Show all citations.

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17 different authors contributed to the 3 articles shown above.

Citations ↓ A–ZAuthor Name ↓ A–Z
3(show)Cui, P.
3(show)Wang, Y.
2(show)Liu, X.
2(show)Su, Z.
2(show)Xing, J.
1(show)Chen, Z.
1(show)Ma, Z.
1(show)Qu, Y.
1(show)Sun, C.
1(show)Sun, M.
1(show)Yao, D.
1(show)Yixin, M.
1(show)Zhang, W.
1(show)Zhang, Z.
1(show)Zhao, J.
1(show)Zhou, M.
1(show)Zhu, Z.

— Journal List —

Only showing results by author “Cui, P.”. Show all citations.

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The 3 articles shown above were published in 2 different journals.

CitationsJournal Name
2(show)J. Mol. Liq.
1(show)Ind. Eng. Chem. Res.