Subject: Re: CCL:Melting Point Prediction

From: Phil Howard <[email-masked]>
Date: Fri, 06 Jun 1997 14:55:30 -0400

At 11:04 AM 6/6/97 EDT, Jane-Jane Ou wrote:
>
>
>Hi,
>
>Is there any reference or software which can predict melting point/
>freezing point by using computer simulation techniques?  Thanks!
>
Jane,
	We have a program that will predict melting point, boiling point, and
vapor pressure from SMILES structural input. See
http://esc.syrres.com/~ESC/mpbpvp.htm

Phil

Philip H. Howard, Ph.D.			Phone:		315-426-3350
Environmental Sciences Center		Fax:		315-426-3429
Syracuse Research Corporation		Email:		[email-masked]
Merrill Lane					http://esc.syrres.com
Syracuse, NY 13210