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Application

Discovery Studio 0.9562955254942768 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.060915867944621935 Amorphous Cell 0.2847710330138445 Blends 0.002129925452609159 CASTEP 0.33269435569755057 CDOCKER 0.16421725239616614 CHARMm 0.2643237486687966 COMPASS 0.33887113951011716 COMPASS III 0.10862619808306709 COSMObase 0.005111821086261981 COSMOconf 0.006389776357827476 COSMOmic 0.0 COSMOperm 4.259850905218317E-4 COSMOplex 2.1299254526091586E-4 COSMOquick 0.0012779552715654952 COSMOtherm 0.06751863684771033 Catalyst 0.0751863684771033 Classical Simulations 1.0 Conformers 4.259850905218317E-4 Crystallization 0.07199148029818957 DFTB Plus 0.003194888178913738 DMol3 0.1531416400425985 DPD 0.0023429179978700747 Discover 0.004259850905218318 Forcite 0.5267305644302449 GULP 0.019382321618743342 Kinetix 2.1299254526091586E-4 LUDI 0.004046858359957401 LibDock 0.06879659211927583 LigandFit 0.004259850905218318 MCSS 2.1299254526091586E-4 MODELER 0.24643237486687966 MesoDyn 6.389776357827476E-4 Mesocite 0.002981895633652822 Mesoscale 0.005750798722044728 Modules 0.0 Morphology 0.01703940362087327 ONETEP 8.519701810436634E-4 Polymorph 0.0019169329073482429 QMERA 2.1299254526091586E-4 QSAR 6.389776357827476E-4 Quantum Mechanics 0.4762513312034079 Reflex 0.05197018104366347 Reflex Plus 6.389776357827476E-4 Semi-empirical 0.004898828541001065 Sorption 0.05708200212992545 Synthia 0.0012779552715654952 TURBOMOLE 0.0 VAMP 0.0010649627263045794 Visualization 0.681150159744409 X-Cell 0.0012779552715654952 ZDOCK 0.027902023429179978

Year

2024 0.38345088594529503 2025 1.0 2026 0.7228625494581111 2027 0.0

Keywords

target 1.0 potential 0.30260688216892595 docking 0.21282586027111575 analysis 0.2127215849843587 visualization 0.15630865484880083 between 0.14640250260688217 novel 0.09019812304483837 promising 0.08561001042752868 energy 0.0786235662148071 binding 0.06788321167883211 cell 0.06235662148070907 activity 0.0424400417101147 performance 0.0410844629822732 stability 0.0410844629822732 including 0.021480709071949947 development 0.014911366006256517 synthesized 0.01470281543274244 effective 0.014598540145985401 experimental 0.01397288842544317 enhanced 0.012721584984358707 mechanism 0.011991657977059436 strong 0.010948905109489052 interaction 0.005422314911366006 strategy 4.171011470281543E-4 design 0.0
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