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Application

Discovery Studio 0.991585473870682 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05758055995773904 Amorphous Cell 0.27469624933967246 Blends 0.0021130480718436345 CASTEP 0.30427892234548337 CDOCKER 0.16957210776545167 CHARMm 0.277337559429477 COMPASS 0.34231378763866877 COMPASS III 0.10195456946645536 COSMObase 0.005282620179609086 COSMOconf 0.005282620179609086 COSMOperm 0.0 COSMOplex 0.0 COSMOquick 0.0010565240359218173 COSMOtherm 0.05916534601162177 Catalyst 0.07131537242472266 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.06973058637083994 DFTB Plus 0.004754358161648178 DMol3 0.1542525092445853 DPD 0.0021130480718436345 Discover 0.006867406233491812 Forcite 0.5182250396196514 GULP 0.01954569466455362 Kinetix 0.0 LUDI 0.003169572107765452 LibDock 0.07290015847860538 LigandFit 0.003169572107765452 MODELER 0.26096143687268886 MesoDyn 0.0010565240359218173 Mesocite 0.002641310089804543 Mesoscale 0.005282620179609086 Morphology 0.013734812466983624 ONETEP 0.0 Polymorph 0.004226096143687269 QMERA 0.0 QSAR 5.282620179609086E-4 Quantum Mechanics 0.4463814051769678 Reflex 0.050184891706286316 Reflex Plus 5.282620179609086E-4 Semi-empirical 0.005282620179609086 Sorption 0.060221870047543584 Synthia 5.282620179609086E-4 Visualization 0.6629688325409403 X-Cell 0.001584786053882726 ZDOCK 0.0306391970417327

Year

2024 0.2357830271216098 2025 1.0 2026 0.8779527559055118 2027 0.0

Keywords

target 1.0 potential 0.3210111443326991 analysis 0.2275074748572982 docking 0.22642022288665398 visualization 0.1524870888828486 between 0.14406088611035608 novel 0.09948355531394401 promising 0.09214460451209568 binding 0.0812720848056537 energy 0.07556401195977168 cell 0.058439793422125574 activity 0.03778200597988584 performance 0.036694754009241645 stability 0.036151128023919545 including 0.025822234302799674 strong 0.02391954335417233 effective 0.017124218537646098 enhanced 0.01005708072845882 development 0.009513454743136722 synthesized 0.008969828757814623 experimental 0.005979885838543082 mechanism 0.004077194889915738 therapeutic 0.0010872519706441968 strategy 2.718129926610492E-4 interaction 0.0
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