• Kemitorvet, 202, 1206

    2800 Kgs. Lyngby

    Denmark

20062023
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Research Output 2006 2019

103 Downloads (Pure)

QSAR modelling of a large imbalanced aryl hydrocarbon activation dataset by rational and random sampling and screening of 80,086 REACH pre-registered and/or registered substances

Klimenko, K. O., Abildgaard Rosenberg, S., Dybdahl, M., Wedebye, E. B. & Nikolov, N. G., 2019, In : PLOS ONE. 14, 3, 21 p., e0213848.

Research output: Contribution to journalJournal articleResearchpeer-review

Open Access
File

Advisory self-classifications for 54,135 substances based on (Q)SAR predictions from the Danish (Q)SAR database, VEGA QSAR and the OECD QSAR Toolbox

Nikolov, N. G., Tyle, H., Løfstedt, M. & Wedebye, E. B., 2018. 2 p.

Research output: Contribution to conferenceConference abstract for conferenceResearchpeer-review

Open Access
File

How many vPvM/PMT substances have been registered under REACH? - vPvM/PMT screening by using the Danish QSAR database

Holmberg, R., Wedebye, E. B., Nikolov, N. G. & Tyle, K., 2018, SETAC Europe 28th Annual Meeting - Abstract book. Brussels, Belgium: Society of Environmental Toxicology and Chemistry, p. 346-346 WE072

Research output: Chapter in Book/Report/Conference proceedingConference abstract in proceedingsResearchpeer-review

Open Access
File

QSAR Models for Constitutive Androstane Receptor (CAR) Activation and Inhibition, and Screening of a Large Set of Environmental Chemicals

Chinen, K., Nikolov, N. G. & Wedebye, E. B., 2018. 2 p.

Research output: Contribution to conferenceConference abstract for conferenceResearchpeer-review

Open Access
File

Recent developments of the Danish (Q)SAR Database: Updates, statistics and link to the OECD QSAR Toolbox

Nikolov, N. G. & Wedebye, E. B., 2018. 1 p.

Research output: Contribution to conferenceConference abstract for conferenceResearchpeer-review

Open Access
File

Projects 2011 2023

Activities 2015 2018

  • 6 Conference presentations
  • 1 Participating in or organising workshops, courses, seminars etc.
  • 1 Talks and presentations in private or public companies and organisations

The effect of rational selection of training sets from an imbalanced AhR activation dataset on QSAR models accuracy and applicability domain coverage for a large set of REACH substances

Eva Bay Wedebye (Other), Nikolai Georgiev Nikolov (Other), Kyrylo Oleksandrovych Klimenko (Guest lecturer)
11 Jun 201815 Jun 2018

Activity: Talks and presentationsConference presentations

QSAR workshop for Danish EPA on development and regulatory application of QSAR and the Danish (Q)SAR Database

Eva Bay Wedebye (Organizer), Nikolai Georgiev Nikolov (Organizer)
31 Oct 2018

Activity: Attending an eventParticipating in or organising workshops, courses, seminars etc.

A free online DTU QSAR predictor powered by Leadscope

Eva Bay Wedebye (Other), Nikolai Georgiev Nikolov (Invited speaker)
4 May 20186 May 2018

Activity: Talks and presentationsConference presentations

Free online Danish (Q)SAR predictions database with >600,000 substances

Eva Bay Wedebye (Invited speaker), Nikolai Georgiev Nikolov (Other)
4 May 20186 May 2018

Activity: Talks and presentationsConference presentations

Prizes

Danish 3R-Center 3R-prize 2016

Eva Bay Wedebye (Recipient) & Nikolai Georgiev Nikolov (Recipient), 15 Sep 2016

Prize: Prizes, scholarships, distinctions