QSAR - Quantitative Structure Activity Modeling in JMP?

Question

Hello,

Can JMP perform "QSAR"  similar types of models?

https://en.wikipedia.org/wiki/Quantitative_structure%E2%80%93activity_relationship

in relation to that can JMP perform "Free-Wilson Analysis"?

Thanks in advance,

Cheers,

Valerie

malcolm_moore1 · Accepted Answer

Hi Valerie,

This is the area of JMP use at Astra Zeneca. They use JMP for Free Wilson analysis and other predictive modelling in contect of QSAR. See slide 23 of AZ Discovery Euope prsentation from 2015: https://community.jmp.com/t5/Discovery-Summit-Europe-2015/A-Million-to-One-Drug-Discovery-Is-a-Numbers-Game/ta-p/22319

Attached is Free-Wilson example in JMP and original paper.

Malcolm

louv · Accepted Answer

Hi Valerie I have attached a couple of papers that seems relevant with a quick Google search on QSAR and JMP. One is from the Royal Society of Chemistry.

Also, I believe Silvio Miccio of P&G presented a paper at Prague Discovery.

https://community.jmp.com/t5/Discovery-Summit-Europe-2017/Increase-Efficiency-and-Model-Applicability-Domain-When-Testing/ta-p/36572