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Application

Discovery Studio 1.0 Materials Studio 0.7700205338809035 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06451612903225806 Amorphous Cell 0.22795698924731184 Blends 0.0 CASTEP 0.4032258064516129 CDOCKER 0.17204301075268819 CHARMm 0.2913978494623656 COMPASS 0.34086021505376346 COMPASS III 0.07419354838709677 COSMObase 0.001075268817204301 COSMOconf 0.0064516129032258064 COSMOperm 0.002150537634408602 COSMOquick 0.0 COSMOtherm 0.08064516129032258 Catalyst 0.12688172043010754 Classical Simulations 0.9612903225806452 Crystallization 0.06989247311827956 DFTB Plus 0.004301075268817204 DMol3 0.16344086021505377 DPD 0.001075268817204301 Discover 0.001075268817204301 Forcite 0.47956989247311826 GULP 0.03118279569892473 Kinetix 0.0 LUDI 0.002150537634408602 LibDock 0.07849462365591398 LigandFit 0.007526881720430108 MODELER 0.2537634408602151 MesoDyn 0.0 Mesoscale 0.002150537634408602 Morphology 0.008602150537634409 Polymorph 0.001075268817204301 QSAR 0.001075268817204301 Quantum Mechanics 0.5591397849462365 Reflex 0.05913978494623656 Semi-empirical 0.007526881720430108 Sorption 0.04516129032258064 Synthia 0.001075268817204301 VAMP 0.002150537634408602 Visualization 1.0 X-Cell 0.0 ZDOCK 0.03333333333333333

Year

2022 0.0 2023 0.2375 2024 0.7528846153846154 2025 1.0 2026 0.275

Keywords

well 1.0 target 0.9453551912568307 potential 0.3097940311055065 docking 0.266078184110971 visualization 0.2101723413198823 analysis 0.19546027742749053 between 0.15510718789407313 binding 0.09415720891130727 novel 0.08238755779739386 activity 0.07229928541403952 energy 0.047078604455653636 promising 0.042454812946616224 experimental 0.03909205548549811 cell 0.03488860865910046 including 0.0332072299285414 stability 0.02648171500630517 interaction 0.021437578814627996 protein 0.021437578814627996 synthesized 0.019335855401429174 mechanism 0.017654476670870115 development 0.012610340479192938 effective 0.007566204287515763 silico 0.0025220680958385876 vitro 0.0025220680958385876 treatment 0.0
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