Search

Categories

Biological and Medicinal Chemistry

(1)

Theoretical and Computational Chemistry

(5)

Content Types

Review

(1)

Working Paper

(4)

Published Date

Last 3 years

(5)

Last 12 months

(5)

Last 6 months

(4)

Last 3 months

(1)

Keywords

Authors

Kenneth Lopez Perez

5 results in Authors: Kenneth Lopez Perez

Theoretical and Computational Chemistry

Alternative weighting schemes for fine-tuned extended similarity index calculations

Kenneth Lopez Perez, Anita Racz, David Bajusz, Camila Gonzalez, Karoly Heberger, Ramon Miranda-Quintana

Version 1 posted 05 February 2024

95

Downloads

Theoretical and Computational Chemistry

Sampling and Mapping Chemical Space with Extended Similarity Indices

Kenneth Lopez Perez, Edgar Lopez Lopez, Jose Luis Medina Franco, Ramon Miranda-Quintana

Version 1 posted 26 July 2023

249

Downloads

Theoretical and Computational Chemistry

Sampling Chemical Space: Activity Cliffs, Extended Similarity, and ML Performance

Kenneth Lopez-Perez, Ramon Miranda-Quintana

Version 1 posted 17 January 2024

333

Downloads

Theoretical and Computational Chemistry

Molecular Similarity: Theory, Applications, and Perspectives

Kenneth Lopez Perez, Juan Avellaneda Tamayo, Lexin Chen, Edgar Lopez Lopez, K. Euridice Juarez Mercado, Jose Luis Medina Franco, Ramon Miranda-Quintana

Version 1 posted 24 November 2023

743

Downloads

Theoretical and Computational Chemistry

iSIM: Instant Similarity

Kenneth Lopez Perez, Taewon Kim, Ramon Miranda-Quintana

Version 1 posted 17 November 2023

882

Downloads