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Application

Discovery Studio 0.8247160789001793 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06236847139850775 Amorphous Cell 0.2934761813659843 Blends 0.001913143294432753 CASTEP 0.3510617945284102 CDOCKER 0.1471207193418787 CHARMm 0.23876028314520759 COMPASS 0.3541228237995026 COMPASS III 0.10828391046489381 COSMObase 0.004782858236081882 COSMOconf 0.005739429883298259 COSMOmic 0.0 COSMOperm 5.739429883298259E-4 COSMOplex 1.913143294432753E-4 COSMOquick 0.0011478859766596518 COSMOtherm 0.06638607231681654 Catalyst 0.06887315859957911 Classical Simulations 1.0 Conformers 3.826286588865506E-4 Crystallization 0.0744212741534341 DFTB Plus 0.003634972259422231 DMol3 0.15821695044958867 DPD 0.0022957719533193035 Discover 0.003826286588865506 Forcite 0.5486894968433136 GULP 0.020279318920987183 Kinetix 1.913143294432753E-4 LUDI 0.0034436579299789555 LibDock 0.06370767170461067 LigandFit 0.0034436579299789555 MCSS 1.913143294432753E-4 MODELER 0.2217333078247561 MesoDyn 7.652573177731012E-4 Mesocite 0.003061029271092405 Mesoscale 0.005930744212741534 Modules 0.0 Morphology 0.017026975320451502 ONETEP 7.652573177731012E-4 Polymorph 0.001913143294432753 QMERA 1.913143294432753E-4 QSAR 7.652573177731012E-4 Quantum Mechanics 0.498947771188062 Reflex 0.054333269561890184 Reflex Plus 7.652573177731012E-4 Semi-empirical 0.005356801224411708 Sorption 0.05796824182131242 Synthia 0.0011478859766596518 TURBOMOLE 0.0 VAMP 0.0011478859766596518 Visualization 0.6326764874689115 X-Cell 0.0015305146355462024 ZDOCK 0.024679548498182515

Year

2024 0.3353532367720958 2025 1.0 2026 0.6256281407035176 2027 0.0

Keywords

target 1.0 potential 0.28855341104528953 analysis 0.20351614752532007 docking 0.18517103000191096 between 0.15192050449073188 visualization 0.1420791133193197 energy 0.0922988725396522 novel 0.08733040321039556 promising 0.0808331740875215 cell 0.06745652589336901 binding 0.056277469902541566 performance 0.05484425759602522 stability 0.04366520160519778 activity 0.033441620485381233 experimental 0.020447162239633096 including 0.019682782342824383 enhanced 0.015860882858780814 effective 0.014523218039365564 mechanism 0.012516720810242691 development 0.011752340913433976 synthesized 0.010510223581119816 interaction 0.007643798968087139 strong 0.006783871584177336 design 0.0025797821517294095 strategy 0.0
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