First computational chemistry multi-target model for anti-Alzheimer, anti-parasitic, anti-fungi, and anti-bacterial activity of GSK-3 inhibitors in vitro, in vivo, and in different cellular lines

Multi-target spectral moment: QSAR for antifungal drugs vs. different fungi species

(2009) Francisco J. Prado-Prado et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Unified QSAR & network-based computational chemistry approach to antimicrobials. II. Multiple distance and triadic census analysis of antiparasitic drugs complex networks

(2009) Francisco J. Prado-Prado et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Rho iso-alpha acids from hops inhibit the GSK-3/NF-κB pathway and reduce inflammatory markers associated with bone and cartilage degradation

(2009) Veera Konda et al.   Journal of Inflammation-London

Prediction of Enzyme Classes from 3D Structure: A General Model and Examples of Experimental-Theoretic Scoring of Peptide Mass Fingerprints ofLeishmaniaProteins

(2009) Riccardo Concu et al.   JOURNAL OF PROTEOME RESEARCH

Predictive QSAR workflow for the in silico identification and screening of novel HDAC inhibitors

(2009) Georgia Melagraki et al.   MOLECULAR DIVERSITY

Glycogen Synthase Kinase 3 Is a Potential Drug Target for African Trypanosomiasis Therapy

(2008) K. K. Ojo et al.   ANTIMICROBIAL AGENTS AND CHEMOTHERAPY

Synthesis of 3,5-bis(2-indolyl)pyridine and 3-[(2-indolyl)-5-phenyl]pyridine derivatives as CDK inhibitors and cytotoxic agents

(2008) Ulrich Jacquemard et al.   BIOORGANIC & MEDICINAL CHEMISTRY

Unified QSAR approach to antimicrobials. 4. Multi-target QSAR modeling and comparative multi-distance study of the giant components of antiviral drug–drug complex networks

(2008) Francisco J. Prado-Prado et al.   BIOORGANIC & MEDICINAL CHEMISTRY

Predicting Antimicrobial Drugs and Targets with the MARCH-INSIDE Approach

(2008) Humberto Gonzalez-Diaz et al.   CURRENT TOPICS IN MEDICINAL CHEMISTRY