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jensengroup
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Fetched on 2024/05/02 12:36
73 Repositories
xyz2mol
236
propka
235
molcalc
81
GB_GA
77
GB-GM
22
protonator
16
fragbuilder
14
ESNUEL
10
atom_mapper
10
RegioSQM
9
take_elementary_step
8
molstat
8
mbh_catalyst_ga
8
FP_RF_XAI
8
compute_pka
8
propka-3.0
7
mol_gen
7
get_conformations
7
UQ_validation_methods
6
String-GA
6
RegioML
6
GA_ChemSpace_exploration
6
AutomatedReactionsMetaMD
6
RegioSQM20
5
ReactionDiscovery
5
TS_conf_search
4
molget
4
HeckQM
4
dha_htvs
4
tmcat-design
3
statsig
3
smiles2coord
3
RMSD_PP_TS
3
procs
3
molcalc-1.3
3
MBH_CatalystDiscovery
3
fragreact
3
db-enzymes
3
xtb_gaussian
2
SI_RegioSQM20
2
protonate
2
procs15
2
optimized-protein-structures
2
GED
2
CHSQM
2
xyz2sdf
1
rdkit_qm_utilities
1
prohxms
1
procs-phaistos
1
pKalculator
1
1
2
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