Index of /~legacy.akohlmey/cpmd-tutor/inputs/12-triade

[ICO]NameLast modifiedSizeDescription
[PARENTDIR]Parent Directory   -  
[TXT]1-his-opt-h-pos.inp 2004-11-07 21:18 1.7K 
[ ]1-prot-triade-wfnopt..>2004-11-09 09:37 5.2K 
[ ]1-triade-wfnopt.inp 2004-11-07 21:43 5.1K 
[ ]1a-prot-triade-wfn.inp 2004-11-07 21:44 5.0K 
[ ]1b-start-triade-wfno..>2004-11-07 21:44 5.0K 
[ ]1c-end-triade-wfnopt..>2004-11-07 21:44 4.8K 
[ ]2-prot-triade-equili..>2004-11-09 09:37 5.3K 
[ ]2-triade-equilib.inp 2004-11-07 21:43 5.2K 
[ ]2a-prot-triade-prop.inp2004-11-07 21:44 5.2K 
[ ]2bc-md-triade-prop.inp 2004-11-07 21:44 5.1K 
[ ]3-prot-triade-cont.inp 2004-11-09 13:19 5.4K 
[ ]3-triade-md.inp 2004-11-07 21:43 5.4K 
[ ]4-triade-cont.inp 2004-11-07 21:43 5.3K 
[ ]AChE.gro 2004-11-07 21:22 2.9M 
[ ]C_MT_BLYP.psp 2025-11-06 19:08 81K 
[ ]C_VDB_BLYP.psp 2025-11-06 19:08 230K 
[ ]H_MT_BLYP.psp 2025-11-06 19:08 52K 
[ ]H_VDB_BLYP.psp 2025-11-06 19:08 84K 
[ ]N_MT_BLYP.psp 2025-11-06 19:08 104K 
[ ]N_VDB_BLYP.psp 2025-11-06 19:08 233K 
[ ]O_MT_BLYP.psp 2025-11-06 19:08 83K 
[ ]O_VDB_BLYP.psp 2025-11-06 19:08 236K 
[TXT]get-his.vmd 2004-11-07 21:18 807  
[TXT]get-triade.vmd 2004-11-07 21:18 814  
[ ]reftrajectory.dcd 2025-11-06 19:08 969K 
[ ]reftrajectory.pdb 2025-11-06 19:08 5.8K