Organize structures by sets not by DOI

2024-12-25 13:53:48 +01:00 · 2020-09-02 10:01:42 +02:00 · 2020-09-02 10:01:42 +02:00 · 01ea5ccbb6
commit 01ea5ccbb6
parent 9a71e723d8
96 changed files with 0 additions and 0 deletions
--- a/static/data/structures/10/1021/acs/jctc/8b00406/acetaldehyde.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b00406/acetaldehyde.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b00406/acetylene.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b00406/acetylene.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b00406/ammonia.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b00406/ammonia.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b00406/carbon_monoxide.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b00406/carbon_monoxide.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b00406/cyclopropene.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b00406/cyclopropene.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b00406/diazomethane.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b00406/diazomethane.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b00406/dinitrogen.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b00406/dinitrogen.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b00406/ethylene.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b00406/ethylene.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b00406/formaldehyde.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b00406/formaldehyde.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b00406/formamide.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b00406/formamide.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b00406/hydrogen_chloride.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b00406/hydrogen_chloride.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b00406/ketene.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b00406/ketene.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b00406/methanimine.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b00406/methanimine.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b00406/nitrosomethane.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b00406/nitrosomethane.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b00406/streptocyanine-c1.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b00406/streptocyanine-c1.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b00406/thioformaldehyde.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b00406/thioformaldehyde.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b00406/water.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b00406/water.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b01205/acrolein.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b01205/acrolein.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b01205/benzene.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b01205/benzene.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b01205/beryllium.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b01205/beryllium.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b01205/butadiene.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b01205/butadiene.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b01205/carbon_dimer.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b01205/carbon_dimer.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b01205/carbon_trimer.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b01205/carbon_trimer.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b01205/ethylene.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b01205/ethylene.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b01205/formaldehyde.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b01205/formaldehyde.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b01205/glyoxal.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b01205/glyoxal.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b01205/hexatriene.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b01205/hexatriene.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b01205/nitrosomethane.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b01205/nitrosomethane.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b01205/nitroxyl.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b01205/nitroxyl.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b01205/pyrazine.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b01205/pyrazine.xyz
--- a/static/data/structures/10/1021/acs/jctc/8b01205/tetrazine.xyz
+++ b/static/data/structures/10/1021/acs/jctc/8b01205/tetrazine.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/acetone.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/acetone.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/acrolein.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/acrolein.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/benzene.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/benzene.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/butadiene.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/butadiene.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/cyanoacetylene.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/cyanoacetylene.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/cyanoformaldehyde.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/cyanoformaldehyde.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/cyanogen.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/cyanogen.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/cyclopentadiene.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/cyclopentadiene.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/cyclopropenethione.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/cyclopropenethione.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/cyclopropenone.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/cyclopropenone.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/diacetylene.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/diacetylene.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/furan.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/furan.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/glyoxal.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/glyoxal.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/imidazole.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/imidazole.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/isobutene.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/isobutene.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/methylenecyclopropene.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/methylenecyclopropene.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/propynal.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/propynal.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/pyrazine.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/pyrazine.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/pyridazine.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/pyridazine.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/pyridine.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/pyridine.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/pyrimidine.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/pyrimidine.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/pyrrole.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/pyrrole.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/tetrazine.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/tetrazine.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/thioacetone.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/thioacetone.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/thiophene.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/thiophene.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/thiopropynal.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/thiopropynal.xyz
--- a/static/data/structures/10/1021/acs/jctc/9b01216/triazine.xyz
+++ b/static/data/structures/10/1021/acs/jctc/9b01216/triazine.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/BeF.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/BeF.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/allyl.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/allyl.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/beh.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/beh.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/bh2.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/bh2.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/carbonylfluoride.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/carbonylfluoride.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/ccl2.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/ccl2.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/cclf.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/cclf.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/cf2.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/cf2.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/ch.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/ch.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/ch3.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/ch3.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/cn.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/cn.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/cno.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/cno.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/co+.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/co+.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/con.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/con.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/difluorodiazirine.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/difluorodiazirine.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/f2bo.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/f2bo.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/f2bs.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/f2bs.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/formylfluoride.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/formylfluoride.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/h2bo.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/h2bo.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/h2po.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/h2po.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/h2ps.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/h2ps.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/hccl.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/hccl.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/hcf.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/hcf.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/hco.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/hco.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/hcp.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/hcp.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/hoc.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/hoc.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/hpo.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/hpo.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/hps.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/hps.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/hsif.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/hsif.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/nco.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/nco.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/nh2.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/nh2.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/nitromethyl.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/nitromethyl.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/no.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/no.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/oh.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/oh.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/ph2.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/ph2.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/sicl2.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/sicl2.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/silylidene.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/silylidene.xyz
--- a/static/data/structures/10/1021/acs/jctc/0c00227/vinyl.xyz
+++ b/static/data/structures/10/1021/acs/jctc/0c00227/vinyl.xyz