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Application

Discovery Studio 0.8755118041641258 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06808510638297872 Amorphous Cell 0.2900709219858156 Blends 0.002718676122931442 CASTEP 0.4073286052009456 CDOCKER 0.15732860520094563 CHARMm 0.23652482269503547 COMPASS 0.3747044917257683 COMPASS III 0.08546099290780142 COSMObase 0.0034278959810874706 COSMOconf 0.004846335697399527 COSMOmic 1.1820330969267139E-4 COSMOperm 0.0010638297872340426 COSMOplex 3.546099290780142E-4 COSMOquick 0.0014184397163120568 COSMOtherm 0.06702127659574468 Cantera 0.0 Catalyst 0.1091016548463357 Classical Simulations 1.0 Conformers 7.092198581560284E-4 Crystallization 0.07754137115839244 DFTB Plus 0.006264775413711584 DMol3 0.1842789598108747 DPD 0.0031914893617021275 Discover 0.004609929078014184 Forcite 0.5509456264775414 GULP 0.023286052009456264 Kinetix 2.3640661938534278E-4 LUDI 0.004373522458628842 LibDock 0.06347517730496453 LigandFit 0.005319148936170213 MCSS 3.546099290780142E-4 MODELER 0.1814420803782506 MesoDyn 0.0010638297872340426 Mesocite 0.003900709219858156 Mesoscale 0.007210401891252955 Modules 0.0 Morphology 0.018085106382978722 ONETEP 0.0013002364066193853 Polymorph 0.002127659574468085 QMERA 2.3640661938534278E-4 QSAR 0.0015366430260047282 Quantum Mechanics 0.5803782505910166 Reflex 0.0566193853427896 Reflex Plus 5.91016548463357E-4 Semi-empirical 0.008156028368794326 Sorption 0.05602836879432624 Synthia 0.0013002364066193853 TURBOMOLE 4.7281323877068556E-4 VAMP 0.0014184397163120568 Visualization 0.7646572104018913 X-Cell 0.0013002364066193853 ZDOCK 0.027423167848699765

Year

2021 0.020356234096692113 2022 0.1878325237103863 2023 0.25179273652556095 2024 0.7359472588480223 2025 1.0 2026 0.4895905621096461 2027 0.0

Keywords

target 1.0 potential 0.2651804670912951 docking 0.1945859872611465 analysis 0.18359872611464967 visualization 0.17892781316348194 between 0.15392781316348195 novel 0.0912420382165605 energy 0.09092356687898089 cell 0.06464968152866242 binding 0.05997876857749469 promising 0.053927813163481955 activity 0.04378980891719745 stability 0.03381104033970276 performance 0.03078556263269639 experimental 0.028715498938428875 interaction 0.025477707006369428 synthesized 0.024681528662420384 effective 0.01762208067940552 mechanism 0.015127388535031847 development 0.012208067940552018 including 0.011464968152866241 synthesis 0.0050424628450106155 design 0.0010615711252653928 protein 4.246284501061571E-4 chemical 0.0
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