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Application

Discovery Studio 0.8127893022458427 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0745679012345679 Amorphous Cell 0.2797530864197531 Blends 0.002962962962962963 CASTEP 0.4745679012345679 CDOCKER 0.14716049382716048 CHARMm 0.2360493827160494 COMPASS 0.4219753086419753 COMPASS III 0.04666666666666667 COSMObase 9.876543209876543E-4 COSMOconf 7.407407407407407E-4 COSMOmic 2.469135802469136E-4 COSMOperm 0.0014814814814814814 COSMOplex 2.469135802469136E-4 COSMOquick 0.0012345679012345679 COSMOtherm 0.061481481481481484 Cantera 0.0 Catalyst 0.09925925925925926 Classical Simulations 1.0 Conformers 0.0014814814814814814 Crystallization 0.0874074074074074 DFTB Plus 0.007901234567901235 DMol3 0.21851851851851853 DPD 0.004691358024691358 Discover 0.005185185185185185 Forcite 0.5392592592592592 GULP 0.03481481481481481 Kinetix 0.0 LUDI 0.0024691358024691358 LibDock 0.06271604938271605 LigandFit 0.0044444444444444444 MCSS 7.407407407407407E-4 MODELER 0.22296296296296297 MesoDyn 0.0034567901234567903 Mesocite 0.005679012345679012 Mesoscale 0.011604938271604939 Morphology 0.018765432098765432 ONETEP 4.938271604938272E-4 Polymorph 0.0019753086419753087 QMERA 2.469135802469136E-4 QSAR 0.0017283950617283952 Quantum Mechanics 0.6780246913580247 Reflex 0.06666666666666667 Semi-empirical 0.011111111111111112 Sorption 0.04864197530864198 Synthia 0.0017283950617283952 TURBOMOLE 7.407407407407407E-4 VAMP 0.0024691358024691358 Visualization 0.7091358024691358 X-Cell 4.938271604938272E-4 ZDOCK 0.024691358024691357

Year

2024 0.0

Keywords

target 1.0 potential 0.2586116637001361 docking 0.17684012145325098 analysis 0.17495550204167104 between 0.1650088995916658 visualization 0.1422887655742854 energy 0.09108993822636373 novel 0.08983352528531044 cell 0.04920950685792064 binding 0.04763899068160402 interaction 0.04083342058423202 activity 0.037168882839493246 promising 0.03591246989843996 experimental 0.034341953722123335 stability 0.027117579311066904 effective 0.01999790597843158 mechanism 0.01884619411579939 synthesized 0.018741493037378286 development 0.00879489058737305 including 0.006386765783687572 synthesis 0.004502146372107632 protein 0.0024081248036854777 chemical 0.001256412941053293 performance 0.001151711862632185 well 0.0
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