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Application

Discovery Studio 0.8886397608370703 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07351010763980047 Amorphous Cell 0.27671304804410607 Blends 0.002887897085849304 CASTEP 0.4594381727487529 CDOCKER 0.15647151483328958 CHARMm 0.2509845103701759 COMPASS 0.4069309530060383 COMPASS III 0.04751903386715674 COSMObase 0.0010501443948542925 COSMOconf 5.250721974271463E-4 COSMOmic 2.6253609871357313E-4 COSMOperm 0.0015752165922814387 COSMOplex 2.6253609871357313E-4 COSMOquick 0.0010501443948542925 COSMOtherm 0.06143344709897611 Cantera 0.0 Catalyst 0.1055395116828564 Classical Simulations 1.0 Conformers 0.0015752165922814387 Crystallization 0.08322394329220267 DFTB Plus 0.00761354686269362 DMol3 0.2121291677605671 DPD 0.0047256497768443165 Discover 0.0039380414807035965 Forcite 0.5290102389078498 GULP 0.03544237332633237 Kinetix 0.0 LUDI 0.002625360987135731 LibDock 0.06668416907324758 LigandFit 0.0047256497768443165 MCSS 7.876082961407193E-4 MODELER 0.23707009713835653 MesoDyn 0.0036755053819900237 Mesocite 0.004988185875557889 Mesoscale 0.011289052244683644 Morphology 0.01785245471252297 ONETEP 5.250721974271463E-4 Polymorph 0.0015752165922814387 QMERA 2.6253609871357313E-4 QSAR 0.0013126804935678655 Quantum Mechanics 0.6579154633762142 Reflex 0.06379627198739826 Semi-empirical 0.010501443948542924 Sorption 0.04673142557101601 Synthia 0.0018377526909950119 TURBOMOLE 7.876082961407193E-4 VAMP 0.002100288789708585 Visualization 0.7498030979259648 X-Cell 2.6253609871357313E-4 ZDOCK 0.026253609871357313

Year

2024 0.0

Keywords

target 1.0 potential 0.2695043221359011 docking 0.1945508261297735 analysis 0.18240507714191925 between 0.16632016632016633 visualization 0.15680052522157786 novel 0.09596235912025386 energy 0.08666156034577087 binding 0.05832147937411095 cell 0.0504431557063136 activity 0.04519093992778203 interaction 0.04497209760367655 promising 0.0413611992559361 experimental 0.033592296750191486 stability 0.029434292592187328 effective 0.02396323448955028 synthesized 0.02319728635518109 mechanism 0.02177481124849546 development 0.013021118284276179 protein 0.012145748987854251 including 0.011489222015537806 synthesis 0.010395010395010396 chemical 0.003501477185687712 well 0.002954371375424007 performance 0.0
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