Lines Matching refs:C
231 # new features for the 238th American Chemical Society National Meeting, Washington, D.C., Aug. 19,…
371 # set quaternionFrame "C";ac = {*.ca}.straightness;
434 # given x = C-alpha, C-carbonyl, or N (depending upon set quaternionFrame)
602 # new feature: (value).label("C++ printf format")
855 # yes yes C yes formalCharge formal charge
862 …R, VAL || 21-23 | ASX, GLX, UNK|| 24-29| A, +A, G, +G, I, +I || 30-35| C, +C, T, +T, U, +U||] <…
880 …e different values depending upon the setting of <b>quaternionFrame</b> as "C" (alpha-carbon based…
938 # %[formalCharge] %C
1589 # {atomno=3}.element = "C"
1605 # new feature: set atomTypes "abcd=>C;efgh=>H" for reading mol2 and mdTop files
1638 # new feature: (Application) -c option checks without loading files; -C option checks with loading …
2359 # vA = C--CA
2360 # vB = C--N[i+1]
2530 # - "c" -- CA-C and CA-N, as per Andy Hanson
2531 # - "q" -- peptide plane CA-C and N'-CA' as per J.R.Quine
2532 # - "p" -- peptide plane CA-C and C-N'
3469 # bug fix: proteins with just C CA N not recognized as such
3479 # new feature: MOL isotope column read; interpreted for D, T, 11C, 13C, 15N (for now)
4098 # new feature: adds H/Br/Cl/I/C logic to aromatic bond assignments
4478 # 30 C, +C, T, +T, U, +U
5768 …and not hetero}.label("ATOM %5i %-4a%1A%3n %1c%4R%1E %8.3x%8.3y%8.3z%6.2Q%6.2b %2e%2C")
5769 …ted and hetero}.label("HETATM%5i %-4a%1A%3n %1c%4R%1E %8.3x%8.3y%8.3z%6.2Q%6.2b %2e%2C")