Daniel Alpízar

4 Questions 8 Answers 0 Followers

Questions related from Daniel Alpízar

Compare small molecules?

Do anyone know how I can overlap related small molecules to compare those? Any suggestion or software would be ok Thanks

12 December 2017 5,186 0 View

I cant open ADT in ubuntu?

Hello Im trying to open ADT in Ubuntu but the console show me this problem: Run ADT from /usr/lib/python2.7/dist-packages/AutoDockTools Traceback (most recent call last): File...

10 October 2017 2,938 0 View

Does anyone know a software that can predict the mass spectrum of a molecule previously optimized?

Hello, I need to predict the mass spectrum of a molecule to compare it with the mass spectrum obtained experimentally, if anyone knows a program or web server that gives me this option I would...

01 January 1970 6,060 3 View

Problems in the geometrical optimization of two Xanthanolids

I am doing the geometrical optimization of two isomers using a restrictive method. When I enter the command to the Gaussian software the output file show that one of the isomers always is...

01 January 1970 658 8 View