Horacio Pérez‐Sánchez

MCC950 closes the active conformation of NLRP3 to an inactive state

Ana Tapia‐Abellán, Diego Angosto-Bazarra, Helios Martínez‐Banaclocha et al. · Nature Chemical Biology · 2019 · 436 citations · Full text

Life Sciences, Biochemistry, Molecular Biology +9

A Comprehensive Docking and MM/GBSA Rescoring Study of Ligand Recognition upon Binding Antithrombin

Xiaohua Zhang, Horacio Pérez‐Sánchez, Felice C. Lightstone · Current Topics in Medicinal Chemistry · 2017 · 191 citations · Full text

Pharmacy, Chemistry, Medicinal Chemistry +17

High-Throughput parallel blind Virtual Screening using BINDSURF

Irene Sánchez-Linares, Horacio Pérez‐Sánchez, José M. Cecilia et al. · BMC Bioinformatics · 2012 · 190 citations · Full text

Pharmacy, Bioinformatics, High-performance Computing +17

Automatic selection of molecular descriptors using random forest: Application to drug discovery

Gaspar Cano, José García‐Rodríguez, Alberto García-García et al. · Expert Systems with Applications · 2016 · 158 citations · Full text

Pharmacy, Medicinal Chemistry, Computational Medicinal Chemistry +15

Application advances of deep learning methods for de novo drug design and molecular dynamics simulation

Qifeng Bai, Shuo Liu, Yanan Tian et al. · Wiley Interdisciplinary Reviews Computational Molecular Science · 2021 · 148 citations · Full text

Pharmacy, Chemistry, Computational Chemistry +9