From: Gadi Oron (gadi_at_proteologics.com)
Date: Mon Apr 26 2004 - 07:05:26 CDT
Hi,
I have found an issue with SMD. When SMD is used, and the starting
timestep is not 0, the SMD force is calculated wrongly.
Compare:
FirstTimeStep = 160000
SMD 160000 -1.00756 -0.140782 29.1221 0 0 5618.41
FirstTimeStep = 0
SMD 0 -1.00756 -0.140782 29.1221 0 0 849.376
A bug?
Regards
-- ================= Gadi ORON, PhD -o- Proteologics ====================== ========== gadi/at/proteologics.com ========== +972 8 9475666 ========== Most burning issues generate far more heat than light. ****************************************************************************** This e-mail message, together with any attachments, contains information of Proteologics, Ltd (Rehovot, Israel) that may be confidential, proprietary copyrighted and/or legally privileged, and is intended solely for the use of the individual or entity named in this message. If you are not the intended recipient, please notify us immediately and do not disclose, distribute, or retain this e-mail or any part of it. Proteologics, Ltd reserves the right to monitor all e-mail communications through its network. ** eSafe scanned this email for viruses, vandals and malicious content. ** ******************************************************************************
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