Is there an equivalent of geomanal/distance_plot.inp in the pyXplor interface ?
specifically, for the statement : pick bond (byresidue ( id $id1)) (byresidue ( id $id2)) geometry evaluate ($distance=$result) which is said to calculate the distance between mass-weighted centroids of the residues. (seems very concise) and is there some other way to calculate atom-pairwise distances using the cdsVector or Vec3 modules. Thanks a lot. --------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------- http://knowdeal.110mb.com Best Web Hosting at Lunarpages.com Coupon : besthostdeal Yahoo! Mail - Your Free E-mail Service
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