Felipe V. Calderan

Publication Activity (10 Years)

Years Active: 2022-2023
Publications (10 Years): 3

Top Topics

Molecular Dynamics

Chemical Structures

Graph Properties

Top Venues

J. Chem. Inf. Model.

ICCSA (Workshops 8)

Publications

Felipe V. Calderan, João Paulo A. de Mendonça, Juarez L. F. Da Silva, Marcos G. Quiles
Guided Clustering for Selecting Representatives Samples in Chemical Databases. ICCSA (Workshops 8) (2023)
Gabriel A. Pinheiro, Felipe V. Calderan, Juarez L. F. Da Silva, Marcos G. Quiles
The impact of low-cost molecular geometry optimization in property prediction via graph neural network. ICMLA (2022)
João Paulo A. de Mendonça, Felipe V. Calderan, Tuanan C. Lourenço, Marcos G. Quiles, Juarez L. F. Da Silva
Theoretical Framework Based on Molecular Dynamics and Data Mining Analyses for the Study of Potential Energy Surfaces of Finite-Size Particles. J. Chem. Inf. Model. 62 (22) (2022)