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Application

Discovery Studio 0.8376100046317739 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06735623691663588 Amorphous Cell 0.2865410663711366 Blends 0.002216475803472479 CASTEP 0.38468168944711245 CDOCKER 0.14825760374338134 CHARMm 0.23593153552518162 COMPASS 0.36744243319788206 COMPASS III 0.09296884620120675 COSMObase 0.004186676517670238 COSMOconf 0.004679226696219677 COSMOmic 1.2313754463735992E-4 COSMOperm 0.0014776505356483192 COSMOplex 1.2313754463735992E-4 COSMOquick 0.001600788080285679 COSMOtherm 0.06526289865780076 Cantera 0.0 Catalyst 0.09038295776382219 Classical Simulations 1.0 Conformers 6.156877231867997E-4 Crystallization 0.07486762713951484 DFTB Plus 0.005418051964043837 DMol3 0.1730082502154907 DPD 0.0024627508927471987 Discover 0.003570988794483438 Forcite 0.5517793375200098 GULP 0.023519271025735748 Kinetix 1.2313754463735992E-4 LUDI 0.0030784386159339984 LibDock 0.061076222140130525 LigandFit 0.0039404014283955175 MCSS 3.694126339120798E-4 MODELER 0.20724048762467676 MesoDyn 9.851003570988794E-4 Mesocite 0.0033247137052087182 Mesoscale 0.006403152321142716 Modules 0.0 Morphology 0.01797808151705455 ONETEP 9.851003570988794E-4 Polymorph 0.0019702007141977587 QMERA 1.2313754463735992E-4 QSAR 9.851003570988794E-4 Quantum Mechanics 0.5466075606452407 Reflex 0.05418051964043837 Reflex Plus 0.0011082379017362395 Semi-empirical 0.007141977588966876 Sorption 0.05861347124738333 Synthia 0.0013545129910109593 TURBOMOLE 3.694126339120798E-4 VAMP 0.0013545129910109593 Visualization 0.6962196773796331 X-Cell 0.001600788080285679 ZDOCK 0.025120059106021424

Year

2023 0.11682551665565725 2024 0.5060866282910258 2025 1.0 2026 0.4011512692271398 2027 0.0

Keywords

target 1.0 potential 0.28366050808314086 analysis 0.19393764434180139 docking 0.19006928406466514 visualization 0.16356812933025405 between 0.15542725173210162 energy 0.09549653579676674 novel 0.09416859122401848 promising 0.06812933025404157 cell 0.06651270207852195 binding 0.057852193995381065 performance 0.04520785219399538 activity 0.04047344110854503 stability 0.04047344110854503 experimental 0.029965357967667437 interaction 0.022863741339491917 synthesized 0.022575057736720555 effective 0.02015011547344111 including 0.019861431870669747 mechanism 0.0168013856812933 development 0.01633949191685912 enhanced 0.007159353348729792 synthesis 0.0019630484988452657 design 5.7736720554272516E-5 protein 0.0
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