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Application

Discovery Studio 1.0 Materials Studio 0.9514549653579677 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06755181347150259 Amorphous Cell 0.27266839378238344 Antibody 3.8860103626943003E-4 Blends 0.0031088082901554403 CASTEP 0.4170984455958549 CDOCKER 0.1882124352331606 CHARMm 0.26580310880829017 COMPASS 0.375 COMPASS III 0.06696891191709844 COSMObase 0.0025906735751295338 COSMOconf 0.0029792746113989636 COSMOmic 2.5906735751295336E-4 COSMOperm 0.0012305699481865286 COSMOplex 4.533678756476684E-4 COSMOquick 0.0016191709844559584 COSMOtherm 0.06424870466321243 Cantera 6.476683937823834E-5 Catalyst 0.12849740932642487 Classical Simulations 1.0 Conformers 0.0016191709844559584 Crystallization 0.07610103626943006 DFTB Plus 0.005958549222797927 DMol3 0.1949481865284974 DPD 0.0033031088082901556 Discover 0.005634715025906736 Forcite 0.5254533678756477 GULP 0.027914507772020727 Kinetix 1.9430051813471502E-4 LUDI 0.006347150259067357 LibDock 0.07344559585492227 LigandFit 0.010686528497409326 MCSS 0.0018134715025906736 MODELER 0.2116580310880829 MesoDyn 0.001878238341968912 Mesocite 0.00466321243523316 Mesoscale 0.008484455958549223 Modules 0.0 Morphology 0.018199481865284976 ONETEP 0.0012305699481865286 Polymorph 0.0020077720207253885 QMERA 3.8860103626943003E-4 QSAR 0.0014896373056994818 Quantum Mechanics 0.5988989637305699 Reflex 0.05582901554404145 Reflex Plus 7.124352331606218E-4 Semi-empirical 0.008290155440414507 Sorption 0.053173575129533676 Synthia 0.0013601036269430052 TURBOMOLE 5.82901554404145E-4 VAMP 0.0018134715025906736 Visualization 0.8933937823834197 X-Cell 0.0011010362694300517 ZDOCK 0.03167098445595855

Year

2019 0.0600963570281464 2020 0.2033640436142338 2021 0.26100921308427016 2022 0.29498774406220946 2023 0.6761051474938721 2024 1.0 2025 0.9666976586932634 2026 0.35931028653537317 2027 0.0

Keywords

target 1.0 potential 0.24361682218003902 docking 0.20918108173141192 visualization 0.20918108173141192 analysis 0.16512044488410021 between 0.1483303478330615 novel 0.09787984920995642 energy 0.07467315455979467 binding 0.06654546426757212 cell 0.05427372135924926 activity 0.053043873486084005 interaction 0.03876694382803519 promising 0.03505066438520974 synthesized 0.025773333689810978 experimental 0.024623693286634763 protein 0.01999839585060022 mechanism 0.017431756810950993 stability 0.015881079057829584 development 0.01138946073844344 synthesis 0.010293291981926583 effective 0.009624896398684598 performance 0.004117316792770633 chemical 0.0013100553431542924 design 1.6041493997807663E-4 including 0.0
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