Predicting adverse drug reactions of two‐drug combinations using structural and transcriptomic drug representations to train an artificial neural network
Adverse drug reactions (ADRs) are pharmacological events triggered by drug interactions
with various sources of origin including drug–drug interactions. While there are many …
with various sources of origin including drug–drug interactions. While there are many …
Combined graph/relational database management system for calculated chemical reaction pathway data
T Gimadiev, R Nugmanov, D Batyrshin… - Journal of Chemical …, 2021 - ACS Publications
Presently, quantum chemical calculations are widely used to generate extensive data sets
for machine learning applications; however, generally, these sets only include information …
for machine learning applications; however, generally, these sets only include information …
Predicting clinical trial outcomes using drug bioactivities through graph database integration and machine learning
V Murali, YP Muralidhar, C Königs… - Chemical Biology & …, 2022 - Wiley Online Library
The ability to estimate the probability of a drug to receive approval in clinical trials provides
natural advantages to optimizing pharmaceutical research workflows. Success rates of …
natural advantages to optimizing pharmaceutical research workflows. Success rates of …
Predicting clinical trial outcomes using drug bioactivities through graph database integration and machine learning
P Athri, V Murali, PY Muralidhar, C Königs, M Nair… - 2022 - chemrxiv.org
The ability to estimate the probability of a drug to receive approval in clinical trials provides
natural advantages to optimizing pharmaceutical research workflows. Success rates of …
natural advantages to optimizing pharmaceutical research workflows. Success rates of …
[PDF][PDF] Design of a Chemical Graph Database to Query on an Atom-Specific Level
S Drenth - researchgate.net
Most molecule-oriented databases allow many different queries. Eg, for the leading
biomolecular database PubChem, molecules can be queried on the molecule name, its …
biomolecular database PubChem, molecules can be queried on the molecule name, its …