Ana Luisa Chávez's repositories
Art-Driven-by-Visual-Representations-of-Chemical-Space-
Please, cite our manuscript: Gaytán-Hernández, D., Chávez-Hernández, A.L., López-López, E., Miranda-Salas, J., Saldívar-González, F. I.& Medina-Franco, J. L. Art driven by visual representations of chemical space. J Cheminform 15, 100 (2023). https://doi.org/10.1186/s13321-023-00770-4
Cursos
Tutoriales de Quimioinformática aplicada al diseño de fármacos
DeepLearningLifeSciences
Example code from the book "Deep Learning for the Life Sciences"
intro_pharma_ai
A collection of Jupyter Notebooks that are designed to teach life science students about deep learning.
Natural-products-subsets-generation
Please, cite our manuscript: Chávez-Hernández, A. L., & Medina-Franco, J. L. (2023). Natural products subsets: Generation and characterization. Artificial Intelligence in the Life Sciences, 3, 100066.
PCA
Principal Component Analysis with Python
rdeditor
Simple RDKit molecule editor GUI using PySide
teachopencadd
TeachOpenCADD: a teaching platform for computer-aided drug design (CADD) using open source packages and data
teachopencadd-feedstock
A conda-smithy repository for teachopencadd.