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M. Cretu

11 papers hereh-index 484 citations19 works total

Matching runs newest-first, so older work may not be attached to this profile yet.

author position
  • first author4
  • middle author7

Across the 11 of 11 papers where every author was matched, so the position is known.

fields
  • cs.LG8
  • physics.chem-ph2
  • physics.atom-ph1

identity via Semantic Scholar / OpenAlex

activity
20202026
most citedSynFlowNet: Design of Diverse and Novel Molecules with Synthesis Constraints

12 citations · 35 across the 11 of their papers we have counts for

collaborators
Showing physics.chem-phShow all

2 papers · 1 filter

physics.chem-ph2021★ 4 cited

Dynamics of translational and rotational thermalization of AlF molecules via collisions with cryogenic helium

Mallikarjun Karra, Miruna T. Cretu, Bretislav Friedrich +3

We investigated helium-mediated translational and rotational thermalization of the aluminum monofluoride (AlF) molecule at cryogenic temperatures via a new ab initio potential…

physics.chem-ph2020★ 8 cited

Predicting second virial coefficients of organic and inorganic compounds using Gaussian Process Regression

Miruna T. Cretu, Jesús Pérez-Ríos

We show that by using intuitive and accessible molecular features it is possible to predict the temperature-dependent second virial coefficient of organic and inorganic compounds u…

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