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Application

Discovery Studio 0.8018372703412073 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.033846153846153845 Amorphous Cell 0.3123076923076923 Blends 0.0 CASTEP 0.27384615384615385 CDOCKER 0.14615384615384616 CHARMm 0.2676923076923077 COMPASS 0.3292307692307692 COMPASS III 0.10923076923076923 COSMObase 0.010769230769230769 COSMOconf 0.0015384615384615385 COSMOplex 0.0 COSMOquick 0.0 COSMOtherm 0.08 Catalyst 0.16615384615384615 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.0876923076923077 DFTB Plus 0.004615384615384616 DMol3 0.1723076923076923 DPD 0.0015384615384615385 Discover 0.0015384615384615385 Forcite 0.5230769230769231 GULP 0.02 Kinetix 0.0 LUDI 0.009230769230769232 LibDock 0.06769230769230769 LigandFit 0.0 MCSS 0.0 MODELER 0.17384615384615384 MesoDyn 0.0 Mesocite 0.0015384615384615385 Mesoscale 0.006153846153846154 Morphology 0.021538461538461538 ONETEP 0.0 Polymorph 0.0 QMERA 0.0015384615384615385 QSAR 0.003076923076923077 Quantum Mechanics 0.44153846153846155 Reflex 0.06307692307692307 Reflex Plus 0.0 Semi-empirical 0.010769230769230769 Sorption 0.06 Synthia 0.0 VAMP 0.0015384615384615385 Visualization 0.46615384615384614 ZDOCK 0.021538461538461538

Year

2024 0.37369207772795215 2025 0.9103139013452914 2026 1.0 2027 0.0

Keywords

design 1.0 target 0.897196261682243 potential 0.2102803738317757 synthesis 0.1588785046728972 docking 0.1425233644859813 novel 0.14018691588785046 promising 0.117601246105919 analysis 0.11526479750778816 between 0.11448598130841121 synthesized 0.10358255451713395 performance 0.10046728971962617 development 0.08177570093457943 cell 0.06775700934579439 energy 0.06775700934579439 visualization 0.04361370716510903 strategy 0.03348909657320872 activity 0.031931464174454825 binding 0.0264797507788162 compound 0.02102803738317757 stability 0.02102803738317757 designed 0.017133956386292833 effective 0.010124610591900311 efficient 0.009345794392523364 enhanced 0.003115264797507788 strong 0.0
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