Oliver Beckstein

Asst Professor

  • 3108 Citations
  • 24 h-Index
20012022

Research output per year

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Research Output

Erratum: Correction: Path Similarity Analysis: A Method for Quantifying Macromolecular Pathways (PLoS computational biology (2015) 11 10 (e1004568))

Seyler, S. L., Kumar, A., Thorpe, M. & Beckstein, O., Jun 1 2019, In : PLoS computational biology. 15, 6, p. e1007136

Research output: Contribution to journalComment/debate

Open Access
  • Learning everywhere: Pervasive machine learning for effective high-performance computation

    Fox, G., Glazier, J., Kadupitiya, J. C. S., Jadhao, V., Kim, M., Qiu, J., Sluka, J. P., Somogy, E., Marathe, M., Adiga, A., Chen, J., Beckstein, O. & Jha, S., May 1 2019, Proceedings - 2019 IEEE 33rd International Parallel and Distributed Processing Symposium Workshops, IPDPSW 2019. Institute of Electrical and Electronics Engineers Inc., p. 422-429 8 p. 8778333. (Proceedings - 2019 IEEE 33rd International Parallel and Distributed Processing Symposium Workshops, IPDPSW 2019).

    Research output: Chapter in Book/Report/Conference proceedingConference contribution

  • 1 Scopus citations

    SAMPL6: calculation of macroscopic pK a values from ab initio quantum mechanical free energies

    Selwa, E., Kenney, I. M., Beckstein, O. & Iorga, B. I., Jan 1 2018, (Accepted/In press) In : Journal of Computer-Aided Molecular Design.

    Research output: Contribution to journalArticle

  • 3 Scopus citations

    Task-parallel analysis of molecular dynamics trajectories

    Paraskevakos, I., Chantzialexiou, G., Luckow, A., Cheatham, T. E., Khoshlessan, M., Beckstein, O., Fox, G. C. & Jha, S., Aug 13 2018, Proceedings of the 47th International Conference on Parallel Processing, ICPP 2018. Association for Computing Machinery, a49

    Research output: Chapter in Book/Report/Conference proceedingConference contribution

  • Ligandbook: An online repository for small and drug-like molecule force field parameters

    Domański, J., Beckstein, O. & Iorga, B. I., Jun 1 2017, In : Bioinformatics. 33, 11, p. 1747-1749 3 p.

    Research output: Contribution to journalArticle

  • 4 Scopus citations

    Projects