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Application

Discovery Studio 0.8672199170124482 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06831955922865014 Amorphous Cell 0.2863911845730028 Blends 0.0022038567493112946 CASTEP 0.3834710743801653 CDOCKER 0.15151515151515152 CHARMm 0.23856749311294767 COMPASS 0.36958677685950414 COMPASS III 0.08848484848484849 COSMObase 0.003966942148760331 COSMOconf 0.004297520661157025 COSMOmic 2.2038567493112948E-4 COSMOperm 0.001322314049586777 COSMOplex 2.2038567493112948E-4 COSMOquick 0.0014325068870523416 COSMOtherm 0.06413223140495868 Cantera 0.0 Catalyst 0.0993939393939394 Classical Simulations 1.0 Conformers 8.815426997245179E-4 Crystallization 0.07537190082644628 DFTB Plus 0.005289256198347108 DMol3 0.17730027548209368 DPD 0.002644628099173554 Discover 0.003746556473829201 Forcite 0.5499724517906336 GULP 0.024573002754820935 Kinetix 2.2038567493112948E-4 LUDI 0.0036363636363636364 LibDock 0.06347107438016529 LigandFit 0.004407713498622589 MCSS 5.509641873278236E-4 MODELER 0.19239669421487604 MesoDyn 0.0014325068870523416 Mesocite 0.003966942148760331 Mesoscale 0.007272727272727273 Modules 0.0 Morphology 0.01785123966942149 ONETEP 8.815426997245179E-4 Polymorph 0.0017630853994490359 QMERA 2.2038567493112948E-4 QSAR 8.815426997245179E-4 Quantum Mechanics 0.5496418732782369 Reflex 0.05509641873278237 Reflex Plus 9.917355371900827E-4 Semi-empirical 0.007162534435261708 Sorption 0.05730027548209366 Synthia 0.0015426997245179064 TURBOMOLE 4.4077134986225897E-4 VAMP 0.0014325068870523416 Visualization 0.7310192837465564 X-Cell 0.0014325068870523416 ZDOCK 0.025674931129476584

Year

2022 0.042120075046904314 2023 0.2074108818011257 2024 0.6269230769230769 2025 1.0 2026 0.39878048780487807 2027 0.0

Keywords

target 1.0 potential 0.2766399675555105 docking 0.19568082733448242 analysis 0.18954679103720978 visualization 0.1751495488188178 between 0.15654466186758592 novel 0.09616749467707594 energy 0.09282165669674541 cell 0.06509175707188482 binding 0.05966744398256109 promising 0.05966744398256109 activity 0.04197505829869208 performance 0.03923755449660347 stability 0.037463246476731216 experimental 0.030112541822974754 interaction 0.02884517895163743 synthesized 0.024789617763358005 effective 0.020125722396836663 including 0.018250025347257427 mechanism 0.01759099665416202 development 0.016830578931359627 protein 0.005931258237858663 synthesis 0.005627091148737707 design 7.097232079489E-4 enhanced 0.0
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