From owner-chemistry@ccl.net Sat Jul 25 23:22:00 2009 From: "Syed Tarique Moin tarisyed*yahoo.com" To: CCL Subject: CCL: Scientific coding Message-Id: <-39849-090725231754-2515-5D/tWg1vrepnJbkv8NqSgw()server.ccl.net> X-Original-From: "Syed Tarique Moin" Date: Sat, 25 Jul 2009 23:17:50 -0400 Sent to CCL by: "Syed Tarique Moin" [tarisyed,+,yahoo.com] Hello, CCl users, I am a student of theoretical chemistry. I do md simulation "classical mechanical and quantum mechanical". I am interested to develop a analysis tool for the trajectory analysis using c programming and java like rdf (radial distribution function) and many others. Can any body guide me how to start from theory to equation, then algorithm and then coding and so on. Regards