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Application

Discovery Studio 0.8724705882352941 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06521739130434782 Amorphous Cell 0.28672150411280845 Blends 0.0017626321974148062 CASTEP 0.3337250293772033 CDOCKER 0.15158636897767333 CHARMm 0.2444183313748531 COMPASS 0.34665099882491185 COMPASS III 0.11104582843713279 COSMObase 0.004700352526439483 COSMOconf 0.006462984723854289 COSMOmic 0.0 COSMOperm 5.875440658049354E-4 COSMOplex 0.0 COSMOquick 0.0 COSMOtherm 0.06933019976498238 Catalyst 0.06698002350176263 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.07931844888366628 DFTB Plus 0.0017626321974148062 DMol3 0.15276145710928318 DPD 0.0023501762632197414 Discover 0.002937720329024677 Forcite 0.5428907168037603 GULP 0.013513513513513514 LUDI 0.0035252643948296123 LibDock 0.05875440658049354 LigandFit 0.002937720329024677 MODELER 0.2256169212690952 Mesocite 0.0035252643948296123 Mesoscale 0.006462984723854289 Morphology 0.019388954171562868 ONETEP 0.0011750881316098707 Polymorph 0.0 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.48237367802585196 Reflex 0.058166862514688604 Reflex Plus 0.0 Semi-empirical 0.004112808460634548 Sorption 0.05052878965922444 Synthia 5.875440658049354E-4 TURBOMOLE 0.0 VAMP 0.0011750881316098707 Visualization 0.6515863689776733 X-Cell 5.875440658049354E-4 ZDOCK 0.022914218566392478

Year

2024 0.1326045627376426 2025 1.0 2026 0.9301330798479087 2027 0.0

Keywords

target 1.0 potential 0.29630759841318277 analysis 0.21391516631065 docking 0.19743667989014344 visualization 0.15440952090326518 between 0.1464754348489472 promising 0.08880073237717424 energy 0.07689960329569728 novel 0.07445834604821483 cell 0.06682941714983216 binding 0.06347268843454379 performance 0.05065608788526091 stability 0.04790967348184315 activity 0.03600854440036619 strong 0.020445529447665547 including 0.018919743667989014 enhanced 0.018614586512053707 development 0.014342386328959414 mechanism 0.013121757705218187 effective 0.011595971925541654 strategy 0.009459871833994507 synthesized 0.005797985962770827 design 0.0024412572474824534 experimental 0.0024412572474824534 interaction 0.0
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