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Application

Discovery Studio 1.0 Materials Studio 0.9775989759531865 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06438535829259569 Amorphous Cell 0.2794801478478598 Blends 0.002026946464766901 CASTEP 0.3679503994276857 CDOCKER 0.16656730654584476 CHARMm 0.2651722904495052 COMPASS 0.35245022057946823 COMPASS III 0.0885894837248122 COSMObase 0.0036961964945749375 COSMOconf 0.004650053654465244 COSMOmic 1.192321449862883E-4 COSMOperm 0.0013115535948491712 COSMOplex 1.192321449862883E-4 COSMOquick 0.0014307857398354596 COSMOtherm 0.06331226898771909 Cantera 0.0 Catalyst 0.11589364492667223 Classical Simulations 1.0 Conformers 5.961607249314415E-4 Crystallization 0.07201621557171814 DFTB Plus 0.005126982234410397 DMol3 0.16454036008107786 DPD 0.0026231071896983425 Discover 0.003576964349588649 Forcite 0.5317753666388458 GULP 0.021581018242518183 Kinetix 1.192321449862883E-4 LUDI 0.0044115893644926674 LibDock 0.06998926910695123 LigandFit 0.004888517944437821 MCSS 5.961607249314415E-4 MODELER 0.2130678430904972 MesoDyn 8.346250149040181E-4 Mesocite 0.0031000357696434958 Mesoscale 0.006080839394300703 Modules 0.0 Morphology 0.01764635745797067 ONETEP 0.0010730893048765948 Polymorph 0.0017884821747943245 QMERA 1.192321449862883E-4 QSAR 9.538571598903064E-4 Quantum Mechanics 0.5222367950399428 Reflex 0.051865983069035414 Reflex Plus 0.0010730893048765948 Semi-empirical 0.006796232264218433 Sorption 0.056754501013473235 Synthia 0.001192321449862883 TURBOMOLE 4.769285799451532E-4 VAMP 0.0013115535948491712 Visualization 0.8131632288064863 X-Cell 0.0014307857398354596 ZDOCK 0.02813878621676404

Year

2022 0.0164589477690039 2023 0.2647702407002188 2024 0.5244030063742746 2025 1.0 2026 0.4044334506707259 2027 0.0

Keywords

target 1.0 potential 0.2920438303954264 docking 0.22735694245937219 analysis 0.2020009528346832 visualization 0.20141866497273833 between 0.1528240961304325 novel 0.10332962786512095 energy 0.08496109258377005 binding 0.075803292573183 promising 0.06796887406701604 cell 0.06442221163517019 activity 0.05748769255200889 stability 0.03975438039277963 interaction 0.032925731829971945 performance 0.031390609284844634 synthesized 0.030278968821131756 experimental 0.026467630088401885 effective 0.021015298290191095 including 0.02090942776983749 mechanism 0.02090942776983749 development 0.020591816208776665 protein 0.01995659308665502 synthesis 0.012016304060134455 design 0.0037054682123762637 enhanced 0.0
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