Subject: MD simulations of liquids and electron transfer

From: [email-masked] (Darren Andrews)
Date: Thu, 13 Jun 1996 15:51:02 +0100

I am looking for a program that will calculate molecular dynamics for
solvent/solute systems where a reaction (electron transfer) occurs.  Is
there a general code for the liquid dynamics bit and is there a standard
way of modelling the reaction?

Cheers.

Darren Andrews.

University of Manchester,
Department of Chemistry,
Oxford road,
Manchester.
M13 9PL.
England.

[email-masked]
PGP: 512/62A971A9

Tel: 0161 275  2000 ext.4699.
Fax: 0161 275 4598.