From zhou "-at-" chem.columbia.edu Tue Nov 22 15:13:55 1994 Received: from cucbs.chem.columbia.edu for zhou |-at-| chem.columbia.edu by www.ccl.net (8.6.9/930601.1506) id OAA15257; Tue, 22 Nov 1994 14:36:01 -0500 From: Received: from quito.chem.columbia.edu by cucbs.chem.columbia.edu with SMTP id AA12258 (5.65c/IDA-1.4.4 for ); Tue, 22 Nov 1994 14:40:13 -0500 Received: by quito.chem.columbia.edu (AIX 3.2/UCB 5.64/4.03) id AA27975; Tue, 22 Nov 1994 14:13:47 -0500 Date: Tue, 22 Nov 1994 14:13:47 -0500 Message-Id: <9411221913.AA27975-!at!-quito.chem.columbia.edu> To: CHEMISTRY -A_T- ccl.net Subject: FMM code Hello. How are you. We are doing molecular dynamics of protein using MD with Multiple-Time-Step Algorithm (RESPA). Now, we hope to include Fast-Multiple-Method (FMM) in our electrostatic calculations. Does anyone have a free code for FMM subroutine or know where to get one? Or, does anyone have interest to collaborate with us to write a particular subroutine for the software we are using, MacroModel. Ruhong (Richard) Zhou Prof. B. J. Berne's group Dept. of Chem. & Center for Biomol. Simul. Columbia University, NY 10027 Tel: 212-854-5650 email: zhou /at\nile.chem.columbia.edu