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Application

Discovery Studio 0.7967143215450213 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06495838093683695 Amorphous Cell 0.29476089440182796 Blends 0.001958544148849355 CASTEP 0.36135139546270606 CDOCKER 0.14199445079157827 CHARMm 0.2306185735270116 COMPASS 0.3623306675371307 COMPASS III 0.1033132038518035 COSMObase 0.004569936347315162 COSMOconf 0.00554920842173984 COSMOmic 1.6321201240411296E-4 COSMOperm 9.792720744246776E-4 COSMOplex 1.6321201240411296E-4 COSMOquick 0.0014689081116370166 COSMOtherm 0.06659050106087808 Catalyst 0.0706708013709809 Classical Simulations 1.0 Conformers 4.896360372123388E-4 Crystallization 0.07295576954463849 DFTB Plus 0.004406724334911049 DMol3 0.16451770850334585 DPD 0.002284968173657581 Discover 0.003590664272890485 Forcite 0.5542679941243676 GULP 0.02170719764974702 Kinetix 1.6321201240411296E-4 LUDI 0.002937816223274033 LibDock 0.061204504651542355 LigandFit 0.003590664272890485 MCSS 1.6321201240411296E-4 MODELER 0.218214460584299 MesoDyn 6.528480496164518E-4 Mesocite 0.003264240248082259 Mesoscale 0.006038844458952179 Modules 0.0 Morphology 0.017300473314835974 ONETEP 8.160600620205648E-4 Polymorph 0.0017953321364452424 QMERA 1.6321201240411296E-4 QSAR 6.528480496164518E-4 Quantum Mechanics 0.5152603231597845 Reflex 0.05271748000652848 Reflex Plus 0.0011424840868287905 Semi-empirical 0.005875632446548066 Sorption 0.05957238452750122 Synthia 0.0013056960992329036 TURBOMOLE 3.264240248082259E-4 VAMP 9.792720744246776E-4 Visualization 0.6309776399543007 X-Cell 0.0016321201240411295 ZDOCK 0.023992165823404604

Year

2023 0.003550006120700208 2024 0.38168686497735343 2025 1.0 2026 0.5196474476680132 2027 0.0

Keywords

target 1.0 potential 0.2862874107357779 analysis 0.20259969509748857 docking 0.18270079435127978 between 0.15822835593356335 visualization 0.14563106796116504 energy 0.10005616625210624 novel 0.09251384096926904 promising 0.08136082805103105 cell 0.07389874027120276 performance 0.05825242718446602 binding 0.05769076466340368 stability 0.04653775174516569 activity 0.033699751263740675 experimental 0.027762176041081603 including 0.024231725908689723 effective 0.022787450854529406 mechanism 0.021022225788333467 enhanced 0.018695338201075183 synthesized 0.018213913183021745 development 0.01676963812886143 interaction 0.0163684506138169 strong 0.0059375752226590705 design 0.005054962689561101 strategy 0.0
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