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Application

Discovery Studio 0.9961788563384059 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06834437086092715 Amorphous Cell 0.27885209713024284 Blends 0.0024724061810154525 CASTEP 0.39470198675496687 CDOCKER 0.17059602649006622 CHARMm 0.25739514348785875 COMPASS 0.36600441501103753 COMPASS III 0.07920529801324504 COSMObase 0.0033554083885209713 COSMOconf 0.0037969094922737307 COSMOmic 2.6490066225165563E-4 COSMOperm 0.0013245033112582781 COSMOplex 3.532008830022075E-4 COSMOquick 0.00141280353200883 COSMOtherm 0.0631346578366446 Cantera 0.0 Catalyst 0.125121412803532 Classical Simulations 1.0 Conformers 0.0010596026490066225 Crystallization 0.07443708609271524 DFTB Plus 0.005474613686534216 DMol3 0.1796026490066225 DPD 0.003002207505518764 Discover 0.0037969094922737307 Forcite 0.535364238410596 GULP 0.02543046357615894 Kinetix 2.6490066225165563E-4 LUDI 0.004591611479028698 LibDock 0.0706401766004415 LigandFit 0.006181015452538631 MCSS 7.947019867549669E-4 MODELER 0.17607064017660043 MesoDyn 0.001501103752759382 Mesocite 0.004061810154525386 Mesoscale 0.007593818984547461 Modules 0.0 Morphology 0.017306843267108168 ONETEP 0.0010596026490066225 Polymorph 0.0017660044150110375 QMERA 2.6490066225165563E-4 QSAR 9.713024282560706E-4 Quantum Mechanics 0.5626490066225166 Reflex 0.054834437086092716 Reflex Plus 7.947019867549669E-4 Semi-empirical 0.007417218543046358 Sorption 0.055364238410596026 Synthia 0.001501103752759382 TURBOMOLE 5.298013245033113E-4 VAMP 0.001501103752759382 Visualization 0.8467991169977925 X-Cell 0.0012362030905077263 ZDOCK 0.029757174392935983

Year

2021 0.003068022440392707 2022 0.22904978962131836 2023 0.37640252454417955 2024 0.8171458625525947 2025 1.0 2026 0.37263323983169705 2027 0.0

Keywords

target 1.0 potential 0.27327865725729544 docking 0.21808125119206562 visualization 0.20747663551401868 analysis 0.18664886515353804 between 0.1538813656303643 novel 0.10246042342170512 energy 0.08636276940682815 binding 0.07125691398054548 cell 0.062139996185390046 activity 0.052260156399008204 promising 0.05222201029944688 interaction 0.03852756055693305 stability 0.03395002860957467 synthesized 0.030783902345985124 experimental 0.02914362006484837 performance 0.024756818615296584 effective 0.020179286667938202 mechanism 0.020026702269692925 protein 0.018729734884608048 development 0.01834827388899485 including 0.014724394430669464 synthesis 0.013541865344268548 design 0.0012206751859622355 chemical 0.0
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