Percepta Platform Archives

Season 2, Episode 5: AI and Drug Discovery—The Past, Present, and Future

Sherry Myles May 04th, 2022

AI-assisted drug discovery is all the rage these days. It seems as if new companies and partnerships are being announced every day. Is this a new phenomenon, or an evolution of what has been done in the past? What are the key challenges standing in the way of computer-assisted drug discovery? For the last episode...

Season 2, Episode 2: Chemical Predictions and Animal Testing—How Computers Saved the Bunnies

nvision-joelm Mar 22nd, 2022

Product safety is critical in the chemical and pharmaceutical industries. Everyone needs to trust the medication they take, the food they eat, and the personal care products they use. Unfortunately, this has required the use of animal testing, which has been a controversial subject for decades. Thanks to scientific advancements, the age of animal testing...

Season 2, Episode 1: Introduction to Chemical Predictions and Machine Learning

nvision-joelm Mar 08th, 2022

Computational chemistry tools are becoming more powerful every day. Machine learning, artificial intelligence, big data… what does it all mean and how does it apply to the chemistry lab? Season 2 of the Analytical Wavelength explores how predictive technology is shaping the future of science. In this episode, we explore the fundamentals of machine learning,...

In silico predictions of absorption of MDI substances after dermal or inhalation exposures to support a category based read-across assessment

nvision-joelm Mar 01st, 2022

Insight into phototransformation mechanism and toxicity evolution of novel and legacy brominated flame retardants in water: A comparative analysis

nvision-joelm Mar 01st, 2022

Introduction to Using (Q)SAR for the Assessment of Potential Mutagenicity of Drug Impurities Under ICH M7

nvision-joelm Feb 24th, 2022

This presentation explains the fundamentals of computational toxicology as a critical aspect of modern impurities control.

Mechanism of Sanhua Decoction in the Treatment of Ischemic Stroke Based on Network Pharmacology Methods and Experimental Verification

nvision-joelm Jan 21st, 2022

This article highlights the use of ADME Suite for ADMET screening of key targets in a study of the mechanism of action of Sanhua Decoction (SHD) in the treatment of ischemic stroke (IS) disease.

Abraham model solute descriptors: effect of structural features on the calculated numerical descriptor values for vanillin and select derivatives

nvision-joelm Jan 13th, 2022

Theoretical Study on the Structures, Spectral Properties, and Drugability of Xenicane-type Diterpenoids from Dictyota dichotoma

nvision-joelm Dec 07th, 2021

Evidence of Rate Limiting Proton Transfer in an S_NAr Aminolysis in Acetonitrile under Synthetically Relevant Conditions

nvision-joelm Oct 25th, 2021

ACD/Labs Blog