Mon, 09 Nov 2026 14:38:05 UTC Log in
Sample structures for IQmol 11.63 MB built 2026-10-12 09:57:32 GMT

Description

This package contains samples for IQmol.

Dependencies

5 total
Requires4
  • rpmlib(CompressedFileNames) <= 3.0.4-1
  • rpmlib(FileDigests) <= 4.6.0-1
  • rpmlib(PayloadFilesHavePrefix) <= 4.0-1
  • rpmlib(PayloadIsZstd) <= 5.4.18-1
Provides1
  • IQmol-samples = 3.2.2-3.fc45
ObsoletesNo Obsoletes
ConflictsNo Conflicts
RecommendsNo Recommends
SuggestsNo Suggests
SupplementsNo Supplements
EnhancesNo Enhances

Files

85
Name ascending sort Size
/usr/share/doc/IQmol-samples 0.00 B
/usr/share/doc/IQmol-samples/3nir.pdb 161.45 KB
/usr/share/doc/IQmol-samples/4hhb.pdb 467.02 KB
/usr/share/doc/IQmol-samples/Acetaldehyde-Freq.out 37.67 KB
/usr/share/doc/IQmol-samples/Dyson.Dyson_(left)_0.0.cube 1.77 MB
/usr/share/doc/IQmol-samples/Dyson.fchk 93.50 KB
/usr/share/doc/IQmol-samples/Dyson.out 60.45 KB
/usr/share/doc/IQmol-samples/ExcitedStates.out 31.81 KB
/usr/share/doc/IQmol-samples/For_g.txt.fchk 236.27 KB
/usr/share/doc/IQmol-samples/L-cysteine-Opt.out 302.93 KB
/usr/share/doc/IQmol-samples/LocalizedOrbitals.fchk 340.07 KB
/usr/share/doc/IQmol-samples/Porphyrin-Orb.FChk 2.34 MB
/usr/share/doc/IQmol-samples/Pyran-RingClosing.out 742.77 KB
/usr/share/doc/IQmol-samples/Water-RPA-NtoNbo.FChk 285.59 KB
/usr/share/doc/IQmol-samples/acrolein 0.00 B
/usr/share/doc/IQmol-samples/acrolein/abs_spectra.dat 671.95 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.inp 1.38 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out 54.58 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files 0.00 B
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_fc_0.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_fc_1.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_fc_10.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_fc_11.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_fc_12.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_fc_13.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_fc_14.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_fc_15.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_fc_16.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_fc_17.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_fc_18.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_fc_2.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_fc_3.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_fc_4.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_fc_5.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_fc_6.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_fc_7.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_fc_8.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_fc_9.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_ht_0.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_ht_1.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_ht_10.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_ht_11.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_ht_12.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_ht_13.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_ht_14.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_ht_15.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_ht_16.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_ht_17.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_ht_18.txt 203.13 KB
/usr/share/doc/IQmol-samples/acrolein/acrolein.out.files/Spec_ht_2.txt 203.13 KB
Files 1–50 of 85 Next →
of 2

Component of

buildroots that installed this RPM

No Buildroots