Risking a potentially trivial question: Is there a program that will calculate the RMS of distances between specified (listed) atoms in two different structures?
As far as I could see, LSQMAN will only compute same with same? Calculate RMSD of M1 A20 A30 A40 A50 And M2 A20 A30 A41 A50 Atom types | CA | B-factor range used: -1000.00 - 10000.00 A2 Nr of atoms to match : ( 3) Nr skipped (B limits) : ( 0) Many thanks, jan ------------------------------------------------------------------------------ Jan Lowe email: [EMAIL PROTECTED] Laboratory of Molecular Biology phone: +44 (0)1223 252969 Medical Research Council fax : +44 (0)1223 213556 Hills Road Cambridge CB2 2QH UK WWW: http://www2.mrc-lmb.cam.ac.uk/groups/JYL/index.html ------------------------------------------------------------------------------