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Application

Discovery Studio 0.8718645150982585 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06760653636654919 Amorphous Cell 0.2853786179643277 Blends 0.0024564776246929405 CASTEP 0.3946384705756702 CDOCKER 0.1510199722311225 CHARMm 0.23923955997009505 COMPASS 0.36697639645412794 COMPASS III 0.08693794723913276 COSMObase 0.003738118124532735 COSMOconf 0.004485741749439282 COSMOmic 1.0680337498664957E-4 COSMOperm 0.0013884438748264444 COSMOplex 2.1360674997329915E-4 COSMOquick 0.0014952472498130942 COSMOtherm 0.06536366549182954 Cantera 0.0 Catalyst 0.10306525686211684 Classical Simulations 1.0 Conformers 8.544269998931966E-4 Crystallization 0.0760440029904945 DFTB Plus 0.005767382249279077 DMol3 0.17718679910285165 DPD 0.0024564776246929405 Discover 0.0032041012495994873 Forcite 0.547687706931539 GULP 0.024351169496956104 Kinetix 3.204101249599487E-4 LUDI 0.003524511374559436 LibDock 0.06354800811705649 LigandFit 0.004165331624479333 MCSS 5.340168749332479E-4 MODELER 0.18989640072626296 MesoDyn 9.612303748798462E-4 Mesocite 0.003631314749546086 Mesoscale 0.006621809249172274 Modules 0.0 Morphology 0.018263377122717077 ONETEP 0.0010680337498664959 Polymorph 0.0019224607497596924 QMERA 1.0680337498664957E-4 QSAR 0.0010680337498664959 Quantum Mechanics 0.5606109153049237 Reflex 0.05511054149311118 Reflex Plus 9.612303748798462E-4 Semi-empirical 0.00747623624906547 Sorption 0.058635052867670616 Synthia 0.0014952472498130942 TURBOMOLE 6.408202499198974E-4 VAMP 0.0013884438748264444 Visualization 0.7468760012816404 X-Cell 0.0013884438748264444 ZDOCK 0.02509879312186265

Year

2022 8.832361773538245E-5 2023 0.25931814167108286 2024 0.5977742448330684 2025 1.0 2026 0.3754636989931108 2027 0.0

Keywords

target 1.0 potential 0.2795651750024374 docking 0.19859608072535828 analysis 0.1915277371551136 visualization 0.17977966266939652 between 0.15740469922979428 novel 0.09700692210197914 energy 0.09520327581164083 cell 0.06429755289070878 promising 0.06268889538851516 binding 0.059666569172272595 activity 0.04265379740664912 stability 0.03870527444671931 performance 0.03831529687042995 experimental 0.030808228526859705 interaction 0.029638295797991616 synthesized 0.02681095836989373 effective 0.019401384420395826 mechanism 0.018377693282636248 including 0.017597738130057522 development 0.01735400214487667 synthesis 0.005995905235448962 protein 0.005654674856195769 design 5.84966364434045E-4 enhanced 0.0
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