Search Results - "Chemistry"

Emerging big data in medicinal chemistry promiscuity analysis as an example /

Table of Contents: “…Contents: Big data criteria in medicinal chemistry -- Data at varying confidence levels -- Promiscuity and polypharmacology -- Compound promiscuity analysis in light of big data criteria -- Promiscuity of screening hits -- Promiscuity across major target families -- Promiscuity of kinase inhibitors.…”
Get full text
Series

Structure-based drug design

Subjects: Get full text

Rules and filters and their impact on success in chemical biology and drug discovery

Table of Contents: “…Contents: Academic targets and the translational gap -- Chemistry & attrition (Reductionism, genomics and high throughput screening) -- Screening diverse compounds (advantages and disadvantages) -- Medicinal chemistry (A pattern recognition discipline) -- Biology and chemistry networks analysis -- Ligand efficiency and selectivity.…”
Get full text
Series

Ligand-based drug design

Subjects: Get full text

AI and big data in drug discovery

Table of Contents: “…Contents: Target discovery from patient data, AI and bioinformatics -- Lead discovery from target data, AI and computational chemistry -- Predicting toxicity and Pk using AI -- Choosing the right algorithms for your question.…”
Get full text
Series

GlycoBioInformatics

Subjects: Get full text
Series

Prediction and design of protein structures and interactions

Subjects: Get full text
Series

Virtual screening

Subjects: Get full text
Series